SCHEMBL4675573

SCHEMBL4675573

NC(=O)Oc1cccc2c1Cc1ccccc1-2

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2B P41595 4/20 0.51
HTR7 P34969 2/20 0.51
RAB9A P51151 4/20 0.48
NPC1 O15118 3/20 0.48
PNMT P11086 1/20 0.46
HTR2C P28335 2/20 0.42
DRD2 P14416 1/20 0.42
ADRA1D P25100 1/20 0.42
HTR2A P28223 1/20 0.42
ADRA1A P35348 1/20 0.42
ADRA1B P35368 1/20 0.42
KDM4E B2RXH2 4/20 0.39
MAPK1 P28482 1/20 0.39
MEN1 O00255 4/20 0.38
KMT2A Q03164 4/20 0.38
ALDH1A1 P00352 4/20 0.38
MAPT P10636 4/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
SRD5A2 P31213 1/20 0.38
HSP90AA1 P07900 1/20 0.36

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
SCHEMBL30643818 1.00 HTR2B (0.51) HTR2BHTR7RAB9ANPC1PNMT
SCHEMBL8840922 0.87 RAB9A (0.54) HTR2BHTR7RAB9ANPC1PNMT
SCHEMBL30616301 0.85 RAB9A (0.49) HTR2BHTR7RAB9ANPC1PNMT
SCHEMBL20917777 0.85 RAB9A (0.49) HTR2BHTR7RAB9ANPC1PNMT
SCHEMBL8655175 0.84 RAB9A (0.48) HTR2BHTR7RAB9ANPC1PNMT
SCHEMBL2131214 0.84 RAB9A (0.55) HTR2BHTR7RAB9ANPC1PNMT
SCHEMBL30695173 0.83 RAB9A (0.47) HTR2BHTR7RAB9ANPC1PNMT
SCHEMBL20886929 0.81 TOP1 (0.51) HTR2BHTR7RAB9ANPC1PNMT
SCHEMBL29112976 0.81 RAB9A (0.46) HTR2BHTR7RAB9ANPC1PNMT
SCHEMBL20886942 0.80 RAB9A (0.48) HTR2BHTR7RAB9ANPC1PNMT

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-7396936-B1 Modulators of calcitonin and amylin receptor activity KEMIA, INC. (US) 2008-07-08 US disclosed