SCHEMBL10840261

SCHEMBL10840261

Cc1cc2c(cc1C)NC(C)(C)C=C2

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.46
ALDH1A1 P00352 2/20 0.46
MAPT P10636 2/20 0.46
HPGD P15428 2/20 0.46
HSD17B10 Q99714 2/20 0.46
LMNA P02545 1/20 0.46
PGR P06401 1/20 0.43
AR P10275 1/20 0.43

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
SCHEMBL10840861 0.85 PGR (0.40) KDM4EALDH1A1MAPTHPGDHSD17B10
SCHEMBL10840316 0.78 PGR (0.42) PGRAR
SCHEMBL9306599 0.71 PGR (0.38) KDM4EALDH1A1MAPTHPGDHSD17B10
SCHEMBL29789712 0.71 HTR2B (0.38) ALDH1A1PGRAR
SCHEMBL2175208 0.71 PGR (0.38) KDM4EALDH1A1MAPTHPGDHSD17B10
SCHEMBL29117338 0.71 HTR2C (0.38) PGRAR
SCHEMBL10841242 0.68 ALDH1A1 (0.46) KDM4EALDH1A1MAPTHPGDHSD17B10
SCHEMBL29789697 0.68 MAPT (0.50) KDM4EALDH1A1MAPTHPGDHSD17B10
SCHEMBL23123274 0.67 PGR (0.39) KDM4EALDH1A1MAPTPGRAR
SCHEMBL29789756 0.67 PGR (0.39) KDM4EALDH1A1MAPTPGRAR

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-0198264-A2 Carbamoyl imidazoles NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1986-10-22 EP disclosed