SCHEMBL8811340

SCHEMBL8811340

Cc1nc2ccc3c(c2c(C)c1C)COc1ccccc1-3

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PGR P06401 1/20 0.41
KCNJ1 P48048 1/20 0.38
THRB P10828 1/20 0.38
MAPT P10636 4/20 0.36
MAOB P27338 6/20 0.35
KDM4E B2RXH2 2/20 0.34
ALDH1A1 P00352 2/20 0.34
LMNA P02545 1/20 0.34
GAA P10253 1/20 0.34
ATM Q13315 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
ALPL P05186 1/20 0.34
HSD17B10 Q99714 1/20 0.34
KMT2A Q03164 1/20 0.33
MIF P14174 1/20 0.33

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
SCHEMBL4814353 0.69 THRB (0.46) THRBMAPTKDM4EALDH1A1LMNA
SCHEMBL918406 0.67 MAPT (0.37) MAPTKDM4EALDH1A1GAAHSD17B10
SCHEMBL1047930 0.67 MAPT (0.44) PGRTHRBMAPTMAOBKDM4E
SCHEMBL4817120 0.66 THRB (0.39) THRBMAPTKDM4EALDH1A1LMNA
SCHEMBL4813066 0.66 ALDH1A1 (0.50) THRBMAPTKDM4EALDH1A1LMNA
SCHEMBL4817068 0.66 THRB (0.38) PGRTHRBMAPTKDM4EALDH1A1
SCHEMBL27704547 0.65 DHFR (0.44) KDM4EALDH1A1ATMHSD17B10
SCHEMBL3234033 0.62 KMT2A (0.40) PGRTHRBMAPTMAOBKDM4E
SCHEMBL21638399 0.62 MAPT (0.51) THRBMAPTMAOBKDM4EALDH1A1
SCHEMBL5654051 0.62 MAPT (0.42) MAPTKDM4EALDH1A1

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-0800519-A1 STEROID RECEPTOR MODULATOR COMPOUNDS AND METHODS LIGAND PHARMACEUTICALS, INC. (US) 1997-10-15 EP claimed
WO-1996019458-A2 STEROID RECEPTOR MODULATOR COMPOUNDS AND METHODS LIGAND PHARMACEUTICALS INCORPORATED (US) 1996-06-27 WO claimed