SCHEMBL10683120

SCHEMBL10683120

CCc1[nH]c(=O)c(N)cc1C(=O)c1ccncc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 5/20 0.53
▸ PDE3A Q14432 5/20 0.53
▸ CDC7 O00311 4/20 0.51
▸ AURKB Q96GD4 2/20 0.43
▸ INCENP Q9NQS7 2/20 0.43
▸ UCHL1 P09936 1/20 0.40
▸ CDK5 Q00535 1/20 0.40
▸ CDK5R1 Q15078 1/20 0.40
▸ KMT2A Q03164 3/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ CYP2C9 P11712 2/20 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
▸ KDM4E B2RXH2 2/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ HPGD P15428 2/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ AURKA O14965 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
SCHEMBL10675823 0.86 CDC7 (0.38) PDE3BPDE3ACDC7UCHL1KMT2A
SCHEMBL10678289 0.85 CDC7 (0.56) PDE3BPDE3ACDC7UCHL1CDK5
SCHEMBL10681806 0.85 PDE3B (0.55) PDE3BPDE3ACDC7UCHL1CDK5
SCHEMBL10681969 0.85 MAPT (0.47) CDC7UCHL1ALDH1A1HPGDLMNA
SCHEMBL10681743 0.84 PDE3B (0.53) PDE3BPDE3ACDC7UCHL1CDK5
SCHEMBL10682462 0.82 MAPT (0.53) UCHL1KMT2ANPSR1ALDH1A1MEN1
SCHEMBL7384727 0.81 PDE3B (0.62) PDE3BPDE3ACDC7CDK5CDK5R1
SCHEMBL10680367 0.80 GAA (0.43) KMT2ANPSR1KDM4EALDH1A1MEN1
SCHEMBL10684544 0.80 CDK5 (0.54) PDE3BPDE3ACDC7CDK5CDK5R1
SCHEMBL10680981 0.79 DRD2 (0.38) PDE3BPDE3ACDC7CYP3A4MAPT

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-4769380-A Cardiotonic 5-benzoyl-1,2-dihydro-2-oxo-3-pyridinecarboxylates MERRELL DOW PHARMACEUTICALS INC. (US) 1988-09-06 — — US disclosed
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