SCHEMBL7705901

SCHEMBL7705901

COc1ccc(N2Cc3ccc(C(C)N4Cc5cnccc5C4=O)cc3C2=O)cc1OC(C)CCc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 2/20 0.42
HTR2C P28335 3/20 0.39
THRB P10828 1/20 0.36
PIK3CG P48736 2/20 0.36
HTR2A P28223 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
TP53 P04637 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
CYP3A4 P08684 2/20 0.35
LMNA P02545 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C19 P33261 1/20 0.35
NPC1 O15118 1/20 0.35
PGR P06401 1/20 0.35
GAA P10253 1/20 0.35
PKM P14618 1/20 0.35
NFKB1 P19838 1/20 0.35
DRD1 P21728 1/20 0.35
HTT P42858 1/20 0.35

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
SCHEMBL8711302 0.90 HTR2C (0.44) MCHR1HTR2CPIK3CGMEN1KMT2A
SCHEMBL7698640 0.90 MCHR1 (0.43) MCHR1HTR2CTHRBPIK3CGHTR2A
SCHEMBL7700345 0.89 MCHR1 (0.43) MCHR1HTR2CTHRBPIK3CGHTR2A
SCHEMBL7697051 0.89 MCHR1 (0.42) MCHR1HTR2CPIK3CGHTR2AMEN1
SCHEMBL7701516 0.86 MCHR1 (0.42) MCHR1HTR2CPIK3CGHTR2ALMNA
SCHEMBL8707222 0.85 MCHR1 (0.45) MCHR1HTR2CPIK3CGHTR2AMEN1
SCHEMBL7694961 0.84 MCHR1 (0.47) MCHR1HTR2CPIK3CGHTR2AMEN1
SCHEMBL7701165 0.81 HTR2C (0.56) MCHR1HTR2CTHRBPIK3CGMEN1
SCHEMBL7699560 0.80 MCHR1 (0.43) MCHR1HTR2CPIK3CGHTR2AMEN1
SCHEMBL7696591 0.79 MCHR1 (0.49) MCHR1HTR2CTHRBPIK3CGHTR2A

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
WO-2002081446-A1 3-CYCLOPENTYLOXY-4-METHOXYPHENYL-ISOINDOLINONE DERIVATIVES AND THE USE THEREOF DAEWOONG CO., LTD. (KR) 2002-10-17 WO disclosed