SCHEMBL8107932

SCHEMBL8107932

CCOC(=O)c1cc(=O)c2cccc(NC(=O)CCCc3ccccc3)c2o1

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 10/20 0.59
L3MBTL1 Q9Y468 2/20 0.53
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
CYSLTR2 Q9NS75 1/20 0.49
CYSLTR1 Q9Y271 1/20 0.49
MAPT P10636 1/20 0.47
RAB9A P51151 2/20 0.47
NPC1 O15118 1/20 0.47
POLB P06746 1/20 0.47
ATM Q13315 1/20 0.46

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
SCHEMBL8122842 0.97 GPR35 (0.58) GPR35L3MBTL1MEN1KMT2ACYSLTR2
SCHEMBL8122225 0.91 GPR35 (0.62) GPR35L3MBTL1MEN1KMT2ACYSLTR2
SCHEMBL8109312 0.88 GPR35 (0.61) GPR35L3MBTL1MEN1KMT2ACYSLTR2
SCHEMBL8106887 0.84 GPR35 (0.64) GPR35MEN1KMT2ACYSLTR2CYSLTR1
SCHEMBL8107145 0.82 GPR35 (0.70) GPR35CYSLTR2CYSLTR1
SCHEMBL4254475 0.82 GPR35 (0.69) GPR35CYSLTR2CYSLTR1
SCHEMBL8106090 0.81 GPR35 (0.62) GPR35CYSLTR2CYSLTR1RAB9ANPC1
SCHEMBL8106151 0.81 MAOB (0.54) L3MBTL1MEN1KMT2AMAPTRAB9A
SCHEMBL7896347 0.79 GPR35 (0.59) GPR35CYSLTR2CYSLTR1
SCHEMBL7897848 0.79 GPR35 (0.59) GPR35CYSLTR2CYSLTR1

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