SCHEMBL4765213

SCHEMBL4765213

Cn1c(=O)c(-c2ccc(CN)cc2)cc2c3cc(C(=O)O)ccc3n(C)c21

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.45
▸ PPARG P37231 1/20 0.40
▸ ALDH1A1 P00352 2/20 0.39
▸ HPGD P15428 2/20 0.39
▸ MAPT P10636 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ DPP4 P27487 3/20 0.36
▸ MMP13 P45452 1/20 0.36
▸ SLC22A8 Q8TCC7 1/20 0.36
▸ TBXAS1 P24557 1/20 0.35
▸ PTGER4 P35408 2/20 0.35
▸ LOXL2 Q9Y4K0 1/20 0.35
▸ RARB P10826 1/20 0.34
▸ HASPIN Q8TF76 1/20 0.34
▸ ACE2 Q9BYF1 1/20 0.34
▸ PARP1 P09874 1/20 0.34

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
SCHEMBL3564918 0.88 LOXL2 (0.47) PPARGALDH1A1HPGDMAPTPTGER4
SCHEMBL3569292 0.86 KDM4E (0.58) KDM4EPPARGALDH1A1HPGDHSD17B10
SCHEMBL2385861 0.84 KDM4E (0.41) KDM4EALDH1A1MAPT
SCHEMBL4762397 0.83 KDM4E (0.46) KDM4EPPARGALDH1A1HPGDMAPT
SCHEMBL4767544 0.82 MEP1B (0.41) KDM4EPPARGMAPTDPP4
SCHEMBL4766131 0.82 HRH3 (0.43) KDM4EPPARGALDH1A1HPGDPTGER4
SCHEMBL3571739 0.79 KDM4E (0.43) KDM4EALDH1A1HPGDMAPTHSD17B10
SCHEMBL1338146 0.76 MEN1 (0.39) KDM4EALDH1A1HPGDMAPTHSD17B10
SCHEMBL1339208 0.76 KDM4E (0.42) KDM4EALDH1A1HPGDMAPT
SCHEMBL1339005 0.76 ALDH1A1 (0.42) KDM4EALDH1A1MAPT

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1742947-B1 6-SUBSTITUTED PYRIDOINDOLONE DERIVATIVES PRODUCTION AND THERAPEUTIC USE THEREOF SANOFI AVENTIS (FR) 2008-08-20 — — EP disclosed
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