SCHEMBL9858100

SCHEMBL9858100

CNCc1c(Cc2ccccc2)ccc2ccccc12

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
LMNA P02545 1/20 0.47
CYP1A2 P05177 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
HSD17B10 Q99714 1/20 0.46
CYP3A4 P08684 1/20 0.46
MAPT P10636 1/20 0.46
GPR55 Q9Y2T6 1/20 0.43
IFNAR1 P17181 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
SCHEMBL3837906 0.84 GPR55 (0.49) CYP1A2CYP2C9CYP2C19HSD17B10GPR55
SCHEMBL9722103 0.83 LMNA (0.43) KDM4EMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL10726190 0.83 GPR55 (0.45) GPR55
SCHEMBL9857461 0.79 KDM4E (0.53) KDM4EMAPTGPR55
SCHEMBL9130030 0.78 NCEH1 (0.46) KDM4EMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL9857931 0.77 KDM4E (0.54) KDM4EMEN1KMT2ACYP3A4MAPT
SCHEMBL10726187 0.76 GPR55 (0.45) KMT2ACYP1A2CYP2C9CYP2C19HSD17B10
SCHEMBL27919162 0.76 GPR55 (0.45) GPR55
SCHEMBL10750274 0.75 GPR55 (0.42) CYP1A2CYP2C9CYP2C19HSD17B10GPR55
SCHEMBL10726621 0.75 GPR55 (0.51) CYP1A2GPR55

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-0310122-B1 ANTIFUNGAL COMPOSITION KAKEN PHARMACEUTICAL CO., LTD. (JP) 1991-07-24 EP claimed