SCHEMBL3324129

SCHEMBL3324129

COc1c[c]ccc1OCc1cccc(F)c1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAOB P27338 8/20 0.54
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
LMNA P02545 2/20 0.48
ALDH1A1 P00352 1/20 0.48
PABPC1 P11940 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
IDO1 P14902 2/20 0.44
AGXT P21549 2/20 0.44
MRGPRX4 Q96LA9 3/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
GAK O14976 1/20 0.42
EGFR P00533 1/20 0.42

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
SCHEMBL3321452 0.84 MAOB (0.48) MAOBMEN1KMT2ALMNAIDO1
SCHEMBL18707380 0.83 FFAR4 (0.48) MAOBALDH1A1IDO1MRGPRX4L3MBTL1
SCHEMBL18707424 0.82 APP (0.47) MAOBMEN1KMT2ALMNAALDH1A1
SCHEMBL339374 0.82 HTR1A (0.53) MAOBMEN1KMT2ASMN1; SMN2MRGPRX4
SCHEMBL5475735 0.82 MAOB (0.51) MAOBMEN1KMT2ALMNAIDO1
SCHEMBL985802 0.82 EGFR (0.47) MAOBLMNAIDO1AGXTMRGPRX4
SCHEMBL12864874 0.77 MAOB (0.56) MAOBMEN1KMT2ALMNAALDH1A1
SCHEMBL182637 0.76 HTR1A (0.53) MAOBKMT2ALMNAALDH1A1SMN1; SMN2
SCHEMBL17210836 0.76 MAOB (0.55) MAOBMEN1KMT2ALMNAALDH1A1
SCHEMBL1406548 0.76 MAOB (0.60) MAOBMEN1KMT2ALMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11020391-B2 CRMP2 sumoylation inhibitors and uses thereof ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2021-06-01 US disclosed
US-20200093822-A1 CRMP2 SUMOYLATION INHIBITORS AND USES THEREOF ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA 2020-03-26 US disclosed
US-10441586-B2 CRMP2 SUMOylation inhibitors and uses thereof ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2019-10-15 US disclosed
US-20180289700-A1 CRMP2 SUMOYLATION INHIBITORS AND USES THEREOF Arizona Board of Regents on Behalf of the University of Arzona (US) 2018-10-11 US disclosed
WO-2017062804-A1 CRMP2 SUMOYLATION INHIBITORS AND USES THEREOF THE ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2017-04-13 WO disclosed
US-20160339027-A1 BICYCLIC HETEROAROMATIC COMPOUNDS AS PROTEIN TYROSINE KINASE INHIBITORS NOVARTIS AG (CH) 2016-11-24 US disclosed
US-20160051551-A1 BICYCLIC HETEROAROMATIC COMPOUNDS AS PROTEIN TYROSINE KINASE INHIBITORS NOVARTIS AG (CH) 2016-02-25 US disclosed
US-9199973-B2 Bicyclic heteroaromatic compounds as protein tyrosine kinase inhibitors NOVARTIS AG (CH) 2015-12-01 US disclosed
US-20150065527-A1 BICYCLIC HETEROAROMATIC COMPOUNDS AS PROTEIN TYROSINE KINASE INHIBITORS NOVARTIS AG (CH) 2015-03-05 US disclosed
US-8912205-B2 Bicyclic heteroaromatic compounds as protein tyrosine kinase inhibitors GLAXOSMITHKLINE LLC (US) 2014-12-16 US disclosed
US-6727256-B1 4-AMINOQUINAZOLINE DERIVATIVES AS ANTICARCINOGENIC AGENTS SMITHKLINE BEECHAM CORPORATION 2004-04-27 US disclosed
US-6713485-B2 ANTIPROLIFERATIVE AGENTS; SIDE EFFECT REDUCTION SMITHKLINE BEECHAM CORPORATION 2004-03-30 US disclosed
US-20030220354-A1 Quinazoline ditosylate salt compounds NOVARTIS AG (CH) 2003-11-27 US disclosed
WO-2003086467-A1 CANCER TREATMENT METHOD COMPRISING ADMINISTERING AN ERB-FAMILY INHIBITOR AND A RAF AND/OR RAS INHIBITOR SMITHKLINE BEECHAM CORPORATION (US) 2003-10-23 WO disclosed
US-20030176451-A1 Reacting a heterocyclic-methanesulfonyl substituted-quinazolineamine compound with amine compound LEO OSPREY LIMITED (GB) 2003-09-18 US disclosed
EP-1294715-A1 QUINAZOLINE DITOSYLATE SALT COMPOUNDS GLAXO GROUP LIMITED (GB) 2003-03-26 EP disclosed
US-20020147205-A1 Heterocyclic compounds NOVARTIS AG (CH) 2002-10-10 US disclosed
WO-2002002552-A1 QUINAZOLINE DITOSYLATE SALT COMPOUNDS GLAXO GROUP LIMITED (GB) 2002-01-10 WO disclosed
EP-1047694-A1 BICYCLIC HETEROAROMATIC COMPOUNDS AS PROTEIN TYROSINE KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2000-11-02 EP disclosed
WO-1999035146-A1 BICYCLIC HETEROAROMATIC COMPOUNDS AS PROTEIN TYROSINE KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 1999-07-15 WO 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 (10 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-20200093822-A1 CRMP2 SUMOYLATION INHIBITORS AND USES THEREOF SUMO2, SUMO1, SUMO3 MAOB 4335/4885MEN1 2976/4885KMT2A 1640/4885
US-20030176451-A1 Reacting a heterocyclic-methanesulfonyl substituted-quinazolineamine compound with amine compound CCNH, HRH2, HRH1 MAOB 110/4885MEN1 215/4885KMT2A 385/4885
US-20020147205-A1 Heterocyclic compounds ERBB2, ERBB3, ERBB4 MAOB 945/4885MEN1 3421/4885KMT2A 2440/4885
US-20160339027-A1 BICYCLIC HETEROAROMATIC COMPOUNDS AS PROTEIN TYROSINE KINASE INHIBITORS ABL1, ERBB2, SRC MAOB 617/4885MEN1 2579/4885KMT2A 1174/4885
US-11020391-B2 CRMP2 sumoylation inhibitors and uses thereof SUMO2, SUMO1, SUMO3 MAOB 4335/4885MEN1 2976/4885KMT2A 1640/4885
US-20180289700-A1 CRMP2 SUMOYLATION INHIBITORS AND USES THEREOF SUMO1, SUMO2, SUMO3 MAOB 4500/4885MEN1 2377/4885KMT2A 2198/4885
US-20160051551-A1 BICYCLIC HETEROAROMATIC COMPOUNDS AS PROTEIN TYROSINE KINASE INHIBITORS ABL1, ERBB2, SRC MAOB 617/4885MEN1 2579/4885KMT2A 1174/4885
US-20150065527-A1 BICYCLIC HETEROAROMATIC COMPOUNDS AS PROTEIN TYROSINE KINASE INHIBITORS ABL1, ERBB2, SRC MAOB 617/4885MEN1 2579/4885KMT2A 1174/4885
US-20030220354-A1 Quinazoline ditosylate salt compounds ERBB4, ABL1, ERBB2 MAOB 3698/4885MEN1 1322/4885KMT2A 1454/4885
US-10441586-B2 CRMP2 SUMOylation inhibitors and uses thereof SUMO1, SUMO2, SUMO3 MAOB 4500/4885MEN1 2377/4885KMT2A 2198/4885

“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.