SCHEMBL5137200

SCHEMBL5137200

CCCCC1(CCCC)CC(=O)CCN1C(=O)O

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.31
PKM P14618 1/20 0.31
RAB9A P51151 1/20 0.30

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
SCHEMBL1835615 0.84 NPSR1 (0.31) KDM4EPKMRAB9A
SCHEMBL642246 0.81 RAB9A (0.31) RAB9A
SCHEMBL29156294 0.65
SCHEMBL21752643 0.65
SCHEMBL10500455 0.62 TSHR (0.36) RAB9A
SCHEMBL25253310 0.61 KDM4E (0.30) KDM4EPKM
SCHEMBL17049040 0.61 CPB2 (0.39) KDM4EPKM
SCHEMBL20504486 0.60 HSD17B10 (0.35)
SCHEMBL20456819 0.60 GNAI3 (0.37)
SCHEMBL8550083 0.60 KDM4E (0.36) KDM4EPKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1960347-A2 17-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 3 (17BETA-HSD3) INHIBITORS Sterix Limited (GB) 2008-08-27 EP disclosed
WO-2007003934-A2 17BETA-HYDR0XYSTER0ID DEHYDROGENASE TYPE 3 (17BETA-HSD3 ) INHIBITORS STERIX LIMITED (GB) 2007-01-11 WO disclosed