SCHEMBL131079

SCHEMBL131079

[S]C1=Cc2cccc3cccc1c23

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 4/20 0.52
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
MAPT P10636 2/20 0.52
ALDH1A1 P00352 6/20 0.44
CES2 O00748 1/20 0.44
BCHE P06276 1/20 0.44
CES1 P23141 1/20 0.44
MCL1 Q07820 1/20 0.44
HSD17B10 Q99714 5/20 0.42
TSHR P16473 3/20 0.42
ATM Q13315 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
S100A4 P26447 1/20 0.41
PABPC1 P11940 3/20 0.39
CASP1 P29466 2/20 0.39
CASP7 P55210 2/20 0.39
CYP3A4 P08684 2/20 0.39
DNMT1 P26358 2/20 0.39
HPGD P15428 3/20 0.38

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
SCHEMBL131080 0.76 MAPK1 (0.55) MAPK1MEN1KMT2AMAPTALDH1A1
SCHEMBL28962436 0.76 MAPK1 (0.55) MAPK1MEN1KMT2AMAPTALDH1A1
SCHEMBL8883107 0.74 MAPK1 (0.44) MAPK1MEN1KMT2AMAPTALDH1A1
SCHEMBL133155 0.73 MEN1 (0.52) MAPK1MEN1KMT2AMAPTALDH1A1
SCHEMBL3289050 0.73 MAPK1 (0.52) MAPK1MEN1KMT2AMAPTALDH1A1
SCHEMBL131366 0.73 ALDH1A1 (0.59) MAPK1MEN1KMT2AMAPTALDH1A1
SCHEMBL130420 0.73 KMT2A (0.59) MAPK1MEN1KMT2AMAPTALDH1A1
SCHEMBL4073489 0.73 MAPK1 (0.74) MAPK1MEN1KMT2AMAPTALDH1A1
SCHEMBL58539 0.73 MAPK1 (0.57) MAPK1MEN1KMT2AMAPTALDH1A1
SCHEMBL4507358 0.73 MAPK1 (0.52) MAPK1MEN1KMT2AMAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0582455-B1 Benzoxazinones as inhibitors of HIV reverse transcriptase MERCK & CO INC (US) 2000-11-02 EP claimed
WO-2024128000-A1 ISOPOLYOXOTUNGSTATE SALT COMPOUND, SOLVATE THEREOF OR MIXTURE OF SAID COMPOUND AND SOLVATE, AND METHOD FOR PRODUCING SAID COMPOUND, SOLVATE OR MIXTURE 東京応化工業株式会社 2024-06-20 WO disclosed
US-11267797-B2 Anticancer agent KYOTO PHARMACEUTICAL INDUSTRIES, LTD. (JP) 2022-03-08 US disclosed
US-20200317630-A1 ANTICANCER AGENT KYOTO PHARMACEUTICAL INDUSTRIES, LTD. (JP) 2020-10-08 US disclosed
US-10689355-B2 Anticancer agent Kyoto Pharmaceuticals Industries, Ltd. (JP) 2020-06-23 US disclosed
EP-2990404-B1 TETRAZOLINONE COMPOUND AND USE OF SAME SUMITOMO CHEMICAL CO (JP) 2020-05-27 EP disclosed
EP-3153508-B1 NAPHTHOFURAN DERIVATIVES FOR USE AS ANTICANCER AGENTS KYOTO PHARMA IND (JP) 2020-03-18 EP disclosed
US-20190322636-A1 NOVEL ANTICANCER AGENT KYOTO PHARMACEUTICAL INDUSTRIES, LTD. (JP) 2019-10-24 US disclosed
US-10377730-B2 Anticancer agent KYOTO PHARMACEUTICAL INDUSTRIES, LTD. (JP) 2019-08-13 US disclosed
US-20180265489-A1 NOVEL ANTICANCER AGENT KYOTO PHARMACEUTICAL INDUSTRIES, LTD. (JP) 2018-09-20 US disclosed
EP-1452521-A1 CYCLIC COMPOUND AND PPAR AGONIST Eisai Co., Ltd. (JP) 2004-09-01 EP disclosed
US-20040102634-A1 Carboxylic acid derivative and salt thereof EISAI R&D MANAGEMENT CO., LTD. (JP) 2004-05-27 US disclosed
EP-1394147-A1 CARBOXYLIC ACID DERIVATIVE AND MEDICINE COMPRISING SALT OR ESTER OF THE SAME Eisai Co., Ltd. (JP) 2004-03-03 EP disclosed
EP-1380562-A1 CARBOXYLIC ACID DERIVATIVE AND SALT THEREOF Eisai Co., Ltd. (JP) 2004-01-14 EP disclosed
EP-1352650-A1 INHIBITORS AGAINST THE PRODUCTION AND RELEASE OF INFLAMMATORY CYTOKINES Institute of Medicinal Molecular Design, Inc. (JP) 2003-10-15 EP disclosed
EP-1216980-A1 CARBOXYLIC ACID DERIVATIVES AND DRUGS CONTAINING THE SAME Eisai Co., Ltd. (JP) 2002-06-26 EP disclosed
US-6162828-A IMMUNOLOGY; ANTIINFLAMMATORY AGENTS; ANTITUMOR AGENTS; BONE DISORDERS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2000-12-19 US disclosed
EP-0582455-B1 Benzoxazinones as inhibitors of HIV reverse transcriptase MERCK & CO INC (US) 2000-11-02 EP disclosed
EP-0820464-A2 CYSTEINE PROTEASE INHIBITOR Takeda Chemical Industries, Ltd. (JP) 1998-01-28 EP disclosed
WO-1996030395-A2 CYSTEINE PROTEASE INHIBITOR TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-10-03 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 (7 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-20200317630-A1 ANTICANCER AGENT TP53, NTPCR, NQO1 MAPK1 2224/4885MEN1 788/4885KMT2A 1928/4885
US-11267797-B2 Anticancer agent TP53, NTPCR, NQO1 MAPK1 2224/4885MEN1 788/4885KMT2A 1928/4885
US-20180265489-A1 NOVEL ANTICANCER AGENT NTPCR, TP53, NME1 MAPK1 2204/4885MEN1 1182/4885KMT2A 1828/4885
US-20040102634-A1 Carboxylic acid derivative and salt thereof GPR119, IRS1, SLC5A1 MAPK1 698/4885MEN1 4091/4885KMT2A 2774/4885
US-20190322636-A1 NOVEL ANTICANCER AGENT NTPCR, TP53, NME1 MAPK1 2204/4885MEN1 1182/4885KMT2A 1828/4885
US-10689355-B2 Anticancer agent TP53, NTPCR, NQO1 MAPK1 2224/4885MEN1 788/4885KMT2A 1928/4885
US-10377730-B2 Anticancer agent TP53, NTPCR, NQO1 MAPK1 2224/4885MEN1 788/4885KMT2A 1928/4885

“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.