SCHEMBL10083509

SCHEMBL10083509

CCOC(=O)c1cc2nc(Cc3cccc(F)c3)[nH]c(=O)c2s1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE5A O76074 3/20 0.58
▸ PTGES O14684 1/20 0.43
▸ ALOX5 P09917 1/20 0.43
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ TRPM8 Q7Z2W7 1/20 0.42
▸ RAB9A P51151 1/20 0.41
▸ CDC7 O00311 3/20 0.41
▸ CCNE1 P24864 3/20 0.41
▸ CDK2 P24941 3/20 0.41
▸ ROCK1 Q13464 3/20 0.41
▸ DBF4 Q9UBU7 3/20 0.41
▸ PDE3B Q13370 2/20 0.41
▸ PDE3A Q14432 2/20 0.41
▸ ALDH1A1 P00352 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ MAPT P10636 2/20 0.39

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
SCHEMBL38373 0.89 PDE5A (0.61) PDE5AMEN1KMT2AL3MBTL1RAB9A
SCHEMBL46289 0.88 PDE5A (0.76) PDE5APTGESALOX5MEN1KMT2A
SCHEMBL38065 0.86 PDE5A (0.77) PDE5AKMT2ARAB9ACDC7CCNE1
SCHEMBL46296 0.84 PDE5A (0.56) PDE5AMEN1KMT2AL3MBTL1RAB9A
SCHEMBL38484 0.83 PDE5A (0.57) PDE5APTGESALOX5MEN1KMT2A
SCHEMBL10084040 0.82 PDE5A (0.59) PDE5AALOX5KMT2ATRPM8RAB9A
SCHEMBL46291 0.82 PDE5A (0.50) PDE5AMEN1KMT2AL3MBTL1RAB9A
SCHEMBL46453 0.81 KDM4E (0.50) PDE5AL3MBTL1RAB9ACDC7CCNE1
SCHEMBL4518554 0.78 KMT2A (0.68) MEN1KMT2AL3MBTL1TRPM8ALDH1A1
SCHEMBL37583 0.77 PDE5A (0.78) PDE5AKMT2ACDC7CCNE1CDK2

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-2012004900-A1 THIENOPYRIMIDINE COMPOUNDS ASKA PHARMACEUTICAL CO., LTD. (JP) 2012-01-12 — — WO disclosed
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