SCHEMBL2089698

SCHEMBL2089698

COc1cc(C(=O)OCc2ccccc2)c(N)cc1OCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.52
NPC1 O15118 1/20 0.50
HPGD P15428 1/20 0.50
RAB9A P51151 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
SRD5A1 P18405 2/20 0.49
SRD5A2 P31213 2/20 0.49
PRKCZ Q05513 1/20 0.49
MEN1 O00255 1/20 0.49
POLB P06746 1/20 0.49
KMT2A Q03164 1/20 0.49
SMPD1 P17405 1/20 0.49
HDAC1 Q13547 1/20 0.49
HDAC8 Q9BY41 1/20 0.49
HDAC6 Q9UBN7 1/20 0.49
HTT P42858 1/20 0.49
CTSV O60911 1/20 0.48
CTSL P07711 1/20 0.48
ALDH1A1 P00352 1/20 0.48
MTNR1A P48039 1/20 0.47

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL23459152 1.00 KDM4E (0.52) KDM4ENPC1HPGDRAB9ASMN1; SMN2
SCHEMBL20897407 0.93 HTT (0.55) NPC1HPGDRAB9ASMN1; SMN2MEN1
SCHEMBL1892032 0.91 KDM4E (0.66) KDM4ENPC1HPGDRAB9ASMN1; SMN2
SCHEMBL1012178 0.91 KDM4E (0.66) KDM4ENPC1HPGDRAB9ASMN1; SMN2
SCHEMBL12310507 0.89 ALDH1A1 (0.58) KDM4ENPC1HPGDRAB9ASMN1; SMN2
SCHEMBL3138320 0.88 CTSV (0.57) KDM4ENPC1HPGDRAB9ASMN1; SMN2
SCHEMBL4728946 0.88 CTSV (0.57) KDM4ENPC1HPGDRAB9ASMN1; SMN2
SCHEMBL4469125 0.87 SMN1; SMN2 (0.52) KDM4ENPC1HPGDRAB9ASMN1; SMN2
SCHEMBL874091 0.87 HTT (0.55) KDM4ENPC1HPGDRAB9ASMN1; SMN2
SCHEMBL159448 0.87 HTT (0.55) KDM4ENPC1HPGDRAB9ASMN1; SMN2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 56 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240150317-A1 Chemical Process for the Synthesis of 4-(4-bromo-2-fluoroanilino)-6-methoxy-7-(1-methylpiperidin-4-ylmethoxy)quinazoline GENZYME CORPORATION (US) 2024-05-09 US disclosed
US-20220033377-A1 Chemical Process for the Synthesis of 4-(4-bromo-2-fluoroanilino)-6-methoxy-7-(1-methylpiperidin-4-ylmethoxy)quinazoline GENZYME CORPORATION (US) 2022-02-03 US disclosed
CN-110629246-B Vantanib and analogue intermediate electro-reduction preparation method thereof 湖南大学 2021-03-16 CN disclosed
CN-110629246-A Vantanib and analogue intermediate electro-reduction preparation method thereof 湖南大学 2019-12-31 CN disclosed
US-20190263782-A1 Chemical Process for the Synthesis of 4-(4-bromo-2-fluoroanilino)-6-methoxy-7-(1-methylpiperidin-4-ylmethoxy)quinazoline GENZYME CORPORATION (US) 2019-08-29 US disclosed
US-10344015-B2 Chemical process for the synthesis of 4-(4-bromo-2-fluoroanilino)-6-methoxy-7-(1-methylpiperidin-4-ylmethoxy)quinazoline GENZYME CORPORATION (US) 2019-07-09 US disclosed
US-20180118716-A1 Chemical Process GENZYME CORPORATION (US) 2018-05-03 US disclosed
US-9815816-B2 Chemical process for the synthesis of 4-(4-bromo-2-fluoroanilino)-6-methoxy-7-(1-methylpiperidin-4-ylmethoxy)quinazoline GENZYME CORPORATION (US) 2017-11-14 US disclosed
US-20160185754-A1 Chemical Process for the Synthesis of 4-(4-bromo-2-fluoroanilino)-6-methoxy-7-(1-methylpiperidin-4-ylmethoxy)quinazoline ASTRAZENECA AB (SE) 2016-06-30 US disclosed
CN-102503898-B Chemical process for preparing quinazoline derivatives ASTRAZENECA SWEDEN AB 2015-03-25 CN disclosed
WO-2008053221-A2 PROCESS FOR PREPARING INDOL- 5 -OXY- QUINAZOLINE DERIVATIVES AND INTERMEDIATES ASTRAZENECA AB (SE) 2008-05-08 WO disclosed
US-7329655-B2 Nitrogenous heterocyclic compounds MILLENNIUM PHARMACEUTICALS, INC. (US) 2008-02-12 US disclosed
WO-2007036713-A2 CHEMICAL PROCESS ASTRAZENECA AB (SE) 2007-04-05 WO disclosed
US-6750218-B2 INHIBITORY ACTIVITY ON PHOSPHORYLATION OF PLATELET-DERIVED GROWTH FACTOR (PDGF) RECEPTOR USEFUL FOR THE TREATMENT OF CELL-PROLIFERATIVE DISEASES SUCH AS ARTERIOSCLEROSIS, VASCULAR REOBSTRUCTION, CANCER AND GLOMERULOSCLEROSIS MILLENNIUMIUM PHARMACEUTICALS, INC. 2004-06-15 US disclosed
US-20030229077-A1 Nitrogen-containing heterocyclic compounds MATSUNO KENJI (JP) 2003-12-11 US disclosed
US-6472391-B2 INHIBIT PHOSPHORYLATION OF PDGF RECEPTOR TO HINDER ABNORMAL CELL GROWTH AND CELL WANDERING; TREATMENT OF CELL-PROLIFERATIVE DISEASES SUCH AS ARTERIOSCLEROSIS, VASCULAR REOBSTRUCTION, CANCER AND GLOMERULOSCLEROSIS. MILLENNIUM PHARMACEUTICALS, INC. 2002-10-29 US disclosed
US-20020068734-A1 Nitrogen-containing heterocyclic compounds MILLENNIUM PHARMACEUTICALS, INC. 2002-06-06 US disclosed
US-6207667-B1 USEFUL FOR THE TREATMENT OF CELL-PROLIFERATIVE DISEASES SUCH AS ARTERIOSCLEROSIS, VASCULAR REOBSTRUCTION, CANCER AND GLOMERULOSCLEROSIS KYOWA HAKKO KOGYO CO., LTD. (JP) 2001-03-27 US disclosed
US-6169088-B1 FOR THE PREVENTION OR TREATMENT OF CELL-PROLIFERATIVE DISEASES SUCH AS ARTERIOSCLEROSIS, VASCULAR REOBSTRUCTION, CANCER AND GLOMERULOSCLEROSIS KYOWA HAKKO KOGYO CO., LTD. (JP) 2001-01-02 US disclosed
EP-0882717-A1 NITROGENOUS HETEROCYCLIC COMPOUNDS KYOWA HAKKO KOGYO KABUSHIKI KAISHA (JP) 1998-12-09 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (8 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030229077-A1 Nitrogen-containing heterocyclic compounds ERBB4, NPR1, PDGFRB KDM4E 2801/4885NPC1 3452/4885HPGD 1194/4885
US-20020068734-A1 Nitrogen-containing heterocyclic compounds PDGFRB, MKI67, PDGFRA KDM4E 2799/4885NPC1 3532/4885HPGD 1009/4885
US-20220033377-A1 Chemical Process for the Synthesis of 4-(4-bromo-2-fluoroanilino)-6-methoxy-7-(1-methylpiperidin-4-ylmethoxy)quinazoline CYP3A4, CYP3A7, CYP4B1 KDM4E 109/4885NPC1 3167/4885HPGD 1110/4885
US-20240150317-A1 Chemical Process for the Synthesis of 4-(4-bromo-2-fluoroanilino)-6-methoxy-7-(1-methylpiperidin-4-ylmethoxy)quinazoline CYP3A4, CYP3A7, CYP4B1 KDM4E 109/4885NPC1 3167/4885HPGD 1110/4885
US-20160185754-A1 Chemical Process for the Synthesis of 4-(4-bromo-2-fluoroanilino)-6-methoxy-7-(1-methylpiperidin-4-ylmethoxy)quinazoline CYP3A4, CYP3A7, CYP4B1 KDM4E 109/4885NPC1 3167/4885HPGD 1110/4885
US-20190263782-A1 Chemical Process for the Synthesis of 4-(4-bromo-2-fluoroanilino)-6-methoxy-7-(1-methylpiperidin-4-ylmethoxy)quinazoline CYP3A4, CYP3A7, CYP4B1 KDM4E 109/4885NPC1 3167/4885HPGD 1110/4885
US-10344015-B2 Chemical process for the synthesis of 4-(4-bromo-2-fluoroanilino)-6-methoxy-7-(1-methylpiperidin-4-ylmethoxy)quinazoline CYP3A4, CYP3A7, CYP4B1 KDM4E 103/4885NPC1 3160/4885HPGD 1163/4885
US-20180118716-A1 Chemical Process CYP3A4, CYP3A5, CYP3A7 KDM4E 342/4885NPC1 2914/4885HPGD 815/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.