SCHEMBL5744064

SCHEMBL5744064

Cn1c(C(=O)O)cc2ccc(F)cc21

nearest known ligand 0.76

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 0.76
ALDH1A1 P00352 3/20 0.76
KDM4E B2RXH2 2/20 0.76
HPGD P15428 2/20 0.76
MCL1 Q07820 2/20 0.62
GPR35 Q9HC97 1/20 0.57
CCR2 P41597 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
SRD5A2 P31213 2/20 0.43
SRD5A1 P18405 1/20 0.43
LMNA P02545 1/20 0.43
GFER P55789 2/20 0.43
DAO P14920 1/20 0.42
IDO1 P14902 1/20 0.41
LDHA P00338 1/20 0.41
TSHR P16473 1/20 0.40

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
SCHEMBL29897910 1.00 HSD17B10 (0.76) HSD17B10ALDH1A1KDM4EHPGDMCL1
SCHEMBL986506 0.86 KDM4E (1.00) HSD17B10ALDH1A1KDM4EHPGDMCL1
SCHEMBL3924468 0.82 L3MBTL1 (0.57) HSD17B10ALDH1A1KDM4EHPGDMCL1
SCHEMBL30885827 0.82 KDM4E (0.53) HSD17B10ALDH1A1KDM4EHPGDMCL1
SCHEMBL29834824 0.82 L3MBTL1 (0.57) HSD17B10ALDH1A1KDM4EHPGDMCL1
SCHEMBL10254076 0.81 MCL1 (0.64) HSD17B10ALDH1A1KDM4EHPGDMCL1
SCHEMBL8664 0.81 LDHA (0.61) HSD17B10ALDH1A1KDM4EHPGDMCL1
SCHEMBL3061835 0.81 MCL1 (0.64) HSD17B10ALDH1A1KDM4EHPGDMCL1
SCHEMBL12466580 0.80 CCR2 (0.57) HSD17B10ALDH1A1KDM4EHPGDMCL1
SCHEMBL2828847 0.79 MCL1 (0.62) HSD17B10ALDH1A1KDM4EHPGDMCL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6759428-B2 SUCH AS N-((1,2)-2-(((CYANO(CYCLOPROPYL)METHYL)AMINO)CARBONYL) CYCLOHEXYL)-1H-INDOLE-2-CARBOXAMIDE; CATHEPSIN K INHIBITORS ROCHE PALO ALTO LLC 2004-07-06 US claimed
US-20040077646-A1 Indole nitriles ROCHE PALO ALTO LLC 2004-04-22 US claimed
CN-114702504-B Trifluoromethyl substituted indolopyranone compound, preparation method thereof and application thereof in antitumor drugs 平顶山学院 2023-04-07 CN disclosed
US-20230039586-A1 BICYCLIC COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS NIDO BIOSCIENCES, INC. 2023-02-09 US disclosed
WO-2023287704-A1 BICYCLIC COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS NIDO BIOSCIENCES, INC. (US) 2023-01-19 WO disclosed
CN-114702504-A Trifluoromethyl substituted indolopyranone compound, preparation method thereof and application thereof in antitumor drugs 平顶山学院 2022-07-05 CN disclosed
EP-3831811-A1 HETEROCYCLIC COMPOUND Fimecs, Inc. (JP) 2021-06-09 EP disclosed
US-9522140-B2 Aryl substituted carboxamide derivatives as calcium or sodium channel blockers RAQUALIA PHARMA INC. (JP) 2016-12-20 US disclosed
US-20150322052-A1 ARYL SUBSTITUTED CARBOXAMIDE DERIVATIVES AS CALCIUM OR SODIUM CHANNEL BLOCKERS RAQUALIA PHARMA INC (JP) 2015-11-12 US disclosed
US-20150322052-A1 ARYL SUBSTITUTED CARBOXAMIDE DERIVATIVES AS CALCIUM OR SODIUM CHANNEL BLOCKERS RAQUALIA PHARMA INC (JP) 2015-11-12 US disclosed
US-9101616-B2 Aryl substituted carboxamide derivatives as calcium or sodium channel blockers RAQUALIA PHARMA INC. (JP) 2015-08-11 US disclosed
CN-100406459-C 3-heteroaryl-3, 5-dihydro-4-oxo-4H-pyridazino [4, 5-b ] indole-1-acetamide derivatives, their preparation and use in therapy SANOFI AVENTIS (FR) 2008-07-30 CN disclosed
CN-100376579-C 3-heteroaryl-3, 5-dihydro-4-oxo-4H-pyridazino [4, 5-b ] indole-1-carboxamide derivatives, preparation and therapeutic use thereof SANOFI AVENTIS (FR) 2008-03-26 CN disclosed
CN-1970538-A Intermediate compounds of 3-heteroaryl-3, 5-dihydro-4-oxo-4H-pyridazino [4, 5-b ] indole-1-acetamide derivatives SANOFI AVENTIS (FR) 2007-05-30 CN disclosed
EP-1458721-B1 3-HETEROARYL-3,5-DIHYDRO-4-OXO-4H-PYRIDAZINO [4,5-B]INDOLE-1-CARBOXAMIDE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC USE SANOFI AVENTIS (FR) 2006-11-22 EP disclosed
EP-1492792-B1 3-HETEROARYL-3,5-DIHYDRO-4-OXO-4H-PYRIDAZINO¬4,5-B|INDOLE-1-ACETAMIDE DERIVATIVES, PREPARATION AND USE THEREOF IN MEDICAMENTS SANOFI AVENTIS (FR) 2006-03-29 EP disclosed
CN-1656099-A 3-heteroaryl-3, 5-dihydro-4-oxo-4H-pyridazino [4, 5-b ] indole-1-acetamide derivatives, their preparation and use in therapy SANOFI AVENTIS (FR) 2005-08-17 CN disclosed
CN-1604898-A 3-heteroaryl-3, 5-dihydro-4-oxo-4H-pyridazino [4, 5-b ] indole-1-carboxamide derivatives, preparation and therapeutic use thereof SANOFI AVENTIS (FR) 2005-04-06 CN disclosed
EP-1458721-A1 3-HETEROARYL-3,5-DIHYDRO-4-OXO-4H-PYRIDAZINO 4,5-B]INDOLE-1-CARBOXAMIDE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC USE Sanofi-Aventis (FR) 2004-09-22 EP disclosed
WO-2003055884-A1 3-HETEROARYL-3,5-DIHYDRO-4-OXO-4H-PYRIDAZINO[4,5-B]INDOLE-1-CARBOXAMIDE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC USE SANOFI-SYNTHELABO (FR) 2003-07-10 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 (3 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-20230039586-A1 BICYCLIC COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS AR, FSHR, NR5A1 HSD17B10 73/4885ALDH1A1 2558/4885KDM4E 1723/4885
US-20150322052-A1 ARYL SUBSTITUTED CARBOXAMIDE DERIVATIVES AS CALCIUM OR SODIUM CHANNEL BLOCKERS CACNA1I, CACNA1G, CACNA1H HSD17B10 3030/4885ALDH1A1 2882/4885KDM4E 830/4885
US-20040077646-A1 Indole nitriles TPH1, IDO1, NAT1 HSD17B10 2073/4885ALDH1A1 535/4885KDM4E 3071/4885

“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.