SCHEMBL9003390

SCHEMBL9003390

CC(C)(C)OC(=O)N1CC2[C@H](C1)C(Cl)CCC2(c1ccccc1)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RORC P51449 7/20 0.45
GPR119 Q8TDV5 1/20 0.42
NAMPT P43490 1/20 0.41
FNTA P49354 1/20 0.41
FNTB P49356 1/20 0.41
TSHR P16473 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
ALOX15 P16050 1/20 0.40
ATM Q13315 1/20 0.40
OPRD1 P41143 1/20 0.40
OPRK1 P41145 1/20 0.40
KDM4E B2RXH2 1/20 0.39
PKM P14618 1/20 0.39
USP30 Q70CQ3 2/20 0.39

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
SCHEMBL9271264 1.00 RORC (0.45) RORCGPR119NAMPTFNTAFNTB
SCHEMBL9003003 0.88 RORC (0.43) RORCGPR119NAMPTFNTAFNTB
SCHEMBL9003159 0.88 RORC (0.43) RORCGPR119NAMPTFNTAFNTB
SCHEMBL9267451 0.88 RORC (0.43) RORCGPR119NAMPTFNTAFNTB
SCHEMBL9002998 0.88 RORC (0.43) RORCGPR119NAMPTFNTAFNTB
SCHEMBL9268937 0.88 RORC (0.43) RORCGPR119NAMPTFNTAFNTB
SCHEMBL9003033 0.87 USP30 (0.45) RORCGPR119FNTAFNTBTSHR
SCHEMBL9262375 0.87 USP30 (0.45) RORCGPR119FNTAFNTBTSHR
SCHEMBL9003029 0.87 USP30 (0.45) RORCGPR119FNTAFNTBTSHR
SCHEMBL9270074 0.87 USP30 (0.45) RORCGPR119FNTAFNTBTSHR

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
US-5508433-A Derivatives of perhydroisoindole and preparation thereof RHONE-POULENC RORER S.A. (FR) 1996-04-16 US disclosed