SCHEMBL7734837

SCHEMBL7734837

CC(=O)c1onc2ccccc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.46
KDM4E B2RXH2 4/20 0.46
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
RBP4 P02753 1/20 0.41
TP53 P04637 2/20 0.41
HSD17B10 Q99714 2/20 0.41
HIF1A Q16665 2/20 0.40
ROCK1 Q13464 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.39
HTT P42858 2/20 0.39
GAA P10253 1/20 0.39
IP6K1 Q92551 3/20 0.38
IP6K3 Q96PC2 3/20 0.38
IP6K2 Q9UHH9 3/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
ELANE P08246 1/20 0.37
MAPT P10636 1/20 0.36
NPC1 O15118 1/20 0.36
POLB P06746 1/20 0.36

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
SCHEMBL570621 0.82 ALDH1A1 (0.47) ALDH1A1KDM4EMEN1KMT2ARBP4
SCHEMBL4129795 0.81 RBP4 (0.41) ALDH1A1KDM4EMEN1KMT2ARBP4
SCHEMBL1756651 0.81 RBP4 (0.41) ALDH1A1KDM4EMEN1KMT2ARBP4
SCHEMBL4602617 0.81 LCK (0.47) ALDH1A1KDM4EMEN1KMT2ARBP4
SCHEMBL8880128 0.80 RBP4 (0.39) ALDH1A1KDM4EMEN1KMT2ARBP4
SCHEMBL17321380 0.80 ELANE (0.40) ALDH1A1KDM4EMEN1KMT2ARBP4
SCHEMBL6170975 0.80 RAB9A (0.43) ALDH1A1KDM4EMEN1KMT2ARBP4
SCHEMBL8232354 0.80 RBP4 (0.41) ALDH1A1KDM4EMEN1KMT2ARBP4
SCHEMBL18703328 0.80 IP6K1 (0.50) ALDH1A1KDM4EMEN1KMT2ARBP4
SCHEMBL25174216 0.78 RBP4 (0.40) ALDH1A1KDM4EMEN1KMT2ARBP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-3272357-B2 2002-04-08 JP claimed
US-5430148-A Antiproliferative quinazolines AGOURON PHARMACEUTICALS, INC. (US) 1995-07-04 US claimed
EP-0637300-A1 ANTIPROLIFERATIVE QUINAZOLINES AGOURON PHARMACEUTICALS, INC. (US) 1995-02-08 EP claimed
WO-1993020055-A1 ANTIPROLIFERATIVE QUINAZOLINES AGOURON PHARMACEUTICALS, INC. (US) 1993-10-14 WO claimed
JP-3099045-A None JP disclosed
WO-2023076218-A1 SPIROTRICYCLE RIPK1 INHIBITORS AND METHODS OF USES THEREOF MERCK SHARP & DOHME LLC (US) 2023-05-04 WO disclosed
US-20220227739-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR MODULATING CFTR PROTEOSTASIS THERAPEUTICS INC (US) 2022-07-21 US disclosed
CN-108430994-B Compounds, compositions and methods for modulating CFTR 蛋白质平衡治疗股份有限公司 2022-04-12 CN disclosed
US-11136313-B2 Compounds, compositions, and methods for modulating CFTR PROTEOSTASIS THERAPEUTICS, INC. (US) 2021-10-05 US disclosed
EP-3359536-B1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR MODULATING CFTR PROTEOSTASIS THERAPEUTICS INC (US) 2021-08-04 EP disclosed
US-20200385365-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR MODULATING CFTR PROTEOSTASIS THERAPEUTICS, INC. 2020-12-10 US disclosed
US-10550106-B2 Compounds, compositions, and methods for modulating CFTR PROTEOSTASIS THERAPEUTICS, INC. (US) 2020-02-04 US disclosed
US-5707992-A MICROBIOCIDES, ANTITUMOR AGENTS AGOURON PHARMACEUTICALS, INC. (US) 1998-01-13 US disclosed
US-5430148-A Antiproliferative quinazolines AGOURON PHARMACEUTICALS, INC. (US) 1995-07-04 US disclosed
EP-0637300-A1 ANTIPROLIFERATIVE QUINAZOLINES AGOURON PHARMACEUTICALS, INC. (US) 1995-02-08 EP disclosed
WO-1993020055-A1 ANTIPROLIFERATIVE QUINAZOLINES AGOURON PHARMACEUTICALS, INC. (US) 1993-10-14 WO disclosed
JP-H0399045-A PRODUCTION OF N-(3,4-DIMETHOXYCINNAMOYL)ANTHRANILIC ACID TOA BOSHOKU KK 1991-04-24 JP disclosed
US-4279823-A REACTION WITH A THALLIUM SALT THAN WITH A CARBON MONOXIDE IN THE PRESENCE OF A NOBLE METAL CATALYST IOWA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 1981-07-21 US disclosed
US-4248622-A PREEMERGENCE CHIMAC SOCIETE ANONYME (BE) 1981-02-03 US disclosed
US-4151170-A Process for the manufacture of indigoid dyes CIBA-GEIGY AG (CH) 1979-04-24 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 (4 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-11136313-B2 Compounds, compositions, and methods for modulating CFTR CFTR, SCNN1B, SCNN1G ALDH1A1 3790/4885KDM4E 4558/4885MEN1 4387/4885
US-20200385365-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR MODULATING CFTR CFTR, SCNN1B, SCNN1G ALDH1A1 3790/4885KDM4E 4558/4885MEN1 4387/4885
US-20220227739-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR MODULATING CFTR CFTR, SCNN1B, SCNN1G ALDH1A1 3790/4885KDM4E 4558/4885MEN1 4387/4885
US-10550106-B2 Compounds, compositions, and methods for modulating CFTR CFTR, SCNN1B, SCNN1G ALDH1A1 3790/4885KDM4E 4558/4885MEN1 4387/4885

“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.