SCHEMBL784330

SCHEMBL784330

C=CC(=O)Nc1ccc(C(=O)OCC)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.61
RAB9A P51151 7/20 0.60
SMN1; SMN2 Q16637 7/20 0.60
MEN1 O00255 5/20 0.60
KMT2A Q03164 5/20 0.60
NPC1 O15118 4/20 0.60
GAA P10253 4/20 0.60
MAPT P10636 3/20 0.60
CASP3 P42574 2/20 0.60
SENP7 Q9BQF6 2/20 0.60
TGM2 P21980 2/20 0.60
TRPV1 Q8NER1 1/20 0.60
TP53 P04637 1/20 0.60
POLB P06746 1/20 0.60
ALDH1A1 P00352 5/20 0.58
KDM4E B2RXH2 1/20 0.58
MAPK1 P28482 2/20 0.57
SENP8 Q96LD8 1/20 0.57
SENP6 Q9GZR1 1/20 0.57
HPGD P15428 2/20 0.55

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
SCHEMBL11410586 0.88 MAPT (0.62) TSHRRAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL12230853 0.85 TGM2 (0.53) TSHRRAB9AMEN1KMT2AMAPT
SCHEMBL13412008 0.84 KDM4E (0.56) TSHRMEN1KMT2AMAPTTGM2
SCHEMBL13412007 0.84 TGM2 (0.64) TSHRRAB9ASMN1; SMN2NPC1MAPT
SCHEMBL14407375 0.84 TGM2 (0.55) RAB9ASMN1; SMN2MEN1KMT2AMAPT
SCHEMBL5037749 0.83 TGM2 (0.67) RAB9ASMN1; SMN2MEN1KMT2ANPC1
SCHEMBL8686785 0.82 KMT2A (0.64) TSHRRAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL4013632 0.82 TSHR (0.67) TSHRRAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL9877349 0.82 TSHR (0.67) TSHRRAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL7825125 0.82 KMT2A (0.64) TSHRRAB9ASMN1; SMN2MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119192953-A Anticorrosive paint for outdoor metal components 河南省阳光防腐涂装有限公司 2024-12-27 CN claimed
CN-118955381-A Pyrazole compound as well as preparation method and application thereof 赣南师范大学 2024-11-15 CN claimed
CN-119192953-A Anticorrosive paint for outdoor metal components 河南省阳光防腐涂装有限公司 2024-12-27 CN disclosed
CN-119192953-A Anticorrosive paint for outdoor metal components 河南省阳光防腐涂装有限公司 2024-12-27 CN disclosed
CN-118955381-A Pyrazole compound as well as preparation method and application thereof 赣南师范大学 2024-11-15 CN disclosed
CN-117263760-A Method for synthesizing tetrahydrobenzene-1-formamide compound by photocatalysis 西南医科大学 2023-12-22 CN disclosed
CN-111936470-B Amidopyrazoles useful as irreversible FGFR inhibitors 上海奕拓医药科技有限责任公司 2022-10-21 CN disclosed
CN-110317173-B Amidopyrazoles useful as irreversible FGFR inhibitors 上海奕拓医药科技有限责任公司 2022-10-11 CN disclosed
US-20210369731-A1 COVALENT TARGETING OF E3 LIGASES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2021-12-02 US disclosed
CN-111936470-A Amidopyrazoles useful as FGFR irreversible inhibitors 中国科学院上海有机化学研究所 2020-11-13 CN disclosed
US-20200062696-A1 COMPOSITIONS AND METHODS FOR INHIBITING RETICULON 4 THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2020-02-27 US disclosed
US-20030022892-A1 Methods for treating cognitive/attention deficit disorders using tetrahydroindolone analogues and derivatives SPECTRUM PHARMACEUTICALS, INC. 2003-01-30 US disclosed
US-20020198218-A1 Synthesis and methods of use of tetrahydroindolone analogues and derivatives SPECTRUM PHARMACEUTICALS, INC. 2002-12-26 US disclosed
WO-2002085904-A1 SNYTHESIS AND METHODS OF USE OF PURINE ANALOGUES AND DERIVATIVES NEOTHERAPEUTICS, INC. (US) 2002-10-31 WO disclosed
WO-2002085856-A1 SYNTHESIS AND METHODS OF USE OF TETRAHYDROINDOLONE ANALOGUES AND DERIVATIVES NEOTHERAPEUTICS, INC. (US) 2002-10-31 WO disclosed
US-20020156277-A1 Synthesis and methods of use of purine analogues and derivatives NEO THERAPEUTICS, INC. 2002-10-24 US disclosed
EP-0409565-A1 Rubber composition useful for tires SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1991-01-23 EP disclosed
US-4940711-A Antihypertensive N-piperazinylalkanoylanilides RECORDATI, S.A., CHEMICAL AND PHARMACEUTICAL COMPANY (CH) 1990-07-10 US disclosed
EP-0120558-A1 Antihypertensive N-piperazinylalkanoylanilides RECORDATI S.A. CHEMICAL and PHARMACEUTICAL COMPANY (CH) 1984-10-03 EP disclosed
US-4021404-A AMIDES, NATURAL AND SYNTHETIC RUBBERS THE GOODYEAR TIRE & RUBBER COMPANY (US) 1977-05-03 US 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 (5 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-20200062696-A1 COMPOSITIONS AND METHODS FOR INHIBITING RETICULON 4 RTN4, RTN3, RCN1 TSHR 4237/4885RAB9A 939/4885SMN1; SMN2 2138/4885
US-20020198218-A1 Synthesis and methods of use of tetrahydroindolone analogues and derivatives CYP11B1, CYP11B2, CYP4A11 TSHR 1910/4885RAB9A 2901/4885SMN1; SMN2 3619/4885
US-20020156277-A1 Synthesis and methods of use of purine analogues and derivatives SLC29A1, ATIC, PNP TSHR 2652/4885RAB9A 1809/4885SMN1; SMN2 1500/4885
US-20210369731-A1 COVALENT TARGETING OF E3 LIGASES RNF114, RNF4, RNF168 TSHR 4065/4885RAB9A 2224/4885SMN1; SMN2 1834/4885
US-20030022892-A1 Methods for treating cognitive/attention deficit disorders using tetrahydroindolone analogues and derivatives DRD4, DRD2, DRD1 TSHR 3517/4885RAB9A 1483/4885SMN1; SMN2 1535/4885

“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.