SCHEMBL7700345

SCHEMBL7700345

COc1ccc(N2Cc3ccc(C(C)N4Cc5cnc(O)cc5C4=O)cc3C2=O)cc1OC(C)CCc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 5/20 0.43
HTR2C P28335 3/20 0.39
HTR2A P28223 1/20 0.36
THRB P10828 1/20 0.36
PDE4A P27815 3/20 0.36
PDE4B Q07343 3/20 0.36
PDE4C Q08493 3/20 0.36
PDE4D Q08499 3/20 0.36
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
TP53 P04637 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
LMNA P02545 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C19 P33261 1/20 0.34
NPC1 O15118 1/20 0.34
PGR P06401 1/20 0.34
CYP3A4 P08684 1/20 0.34
GAA P10253 1/20 0.34
PKM P14618 1/20 0.34

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
SCHEMBL7698640 0.92 MCHR1 (0.43) MCHR1HTR2CHTR2ATHRBPDE4A
SCHEMBL7705901 0.89 MCHR1 (0.42) MCHR1HTR2CHTR2ATHRBPDE4A
SCHEMBL7699082 0.86 MCHR1 (0.43) MCHR1HTR2CHTR2APDE4APDE4B
SCHEMBL7697825 0.83 MCHR1 (0.43) MCHR1HTR2CHTR2APDE4APDE4B
SCHEMBL7694961 0.83 MCHR1 (0.47) MCHR1HTR2CHTR2APDE4APDE4B
SCHEMBL7697051 0.81 MCHR1 (0.42) MCHR1HTR2CHTR2APDE4APDE4B
SCHEMBL7696591 0.80 MCHR1 (0.49) MCHR1HTR2CHTR2ATHRBPDE4A
SCHEMBL7701165 0.79 HTR2C (0.56) MCHR1HTR2CTHRBPDE4APDE4B
SCHEMBL7700309 0.78 MCHR1 (0.44) MCHR1HTR2CHTR2APDE4APDE4B
SCHEMBL7693775 0.78 MCHR1 (0.44) MCHR1HTR2CHTR2APDE4APDE4B

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