SCHEMBL8106090

SCHEMBL8106090

NC(=O)c1cc(=O)c2cccc(NC(=O)CCCCc3ccccc3)c2o1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 13/20 0.62
CYSLTR2 Q9NS75 3/20 0.50
CYSLTR1 Q9Y271 3/20 0.50
GPR55 Q9Y2T6 1/20 0.47
POLB P06746 1/20 0.44
PKM P14618 1/20 0.44
HPGD P15428 1/20 0.44
ABCC4 O15439 1/20 0.44
ABCB11 O95342 1/20 0.44
PGR P06401 1/20 0.44
HTR1A P08908 1/20 0.44
AR P10275 1/20 0.44
CHRM1 P11229 1/20 0.44
DRD1 P21728 1/20 0.44
PTGS1 P23219 1/20 0.44
SLC6A2 P23975 1/20 0.44
PDE4A P27815 1/20 0.44
ADORA1 P30542 1/20 0.44
ADRA1A P35348 1/20 0.44
OPRM1 P35372 1/20 0.44

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
SCHEMBL8106887 0.97 GPR35 (0.64) GPR35CYSLTR2CYSLTR1GPR55POLB
SCHEMBL7897848 0.91 GPR35 (0.59) GPR35CYSLTR2CYSLTR1GPR55ABCC4
SCHEMBL7896347 0.91 GPR35 (0.59) GPR35CYSLTR2CYSLTR1GPR55ABCC4
SCHEMBL8109312 0.87 GPR35 (0.61) GPR35CYSLTR2CYSLTR1GPR55POLB
SCHEMBL6956919 0.87 GPR35 (0.57) GPR35CYSLTR2CYSLTR1GPR55ABCC4
SCHEMBL6951132 0.87 GPR35 (0.57) GPR35CYSLTR2CYSLTR1GPR55ABCC4
SCHEMBL7897075 0.85 GPR35 (0.62) GPR35CYSLTR2CYSLTR1GPR55POLB
SCHEMBL8122842 0.85 GPR35 (0.58) GPR35CYSLTR2CYSLTR1GPR55RAB9A
SCHEMBL8122225 0.84 GPR35 (0.62) GPR35CYSLTR2CYSLTR1GPR55POLB
SCHEMBL6955419 0.82 GPR35 (0.53) GPR35CYSLTR2CYSLTR1ABCC4ABCB11

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0634409-B1 Process of producing 2-cyano-4-oxo-4H-benzopyran compounds SUMITOMO CHEMICAL CO (JP) 2000-04-26 EP disclosed
US-5659051-A Process of producing 2-cyano-4-oxo-4H-benzopyran compounds SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-08-19 US disclosed
EP-0634409-A1 Process of producing 2-cyano-4-oxo-4H-benzopyran compounds SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1995-01-18 EP disclosed