SCHEMBL9668975

SCHEMBL9668975

Cc1c(-c2ccncc2)[nH]c2ccc(C3=NNC(=O)CC3C)cc12

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 15/20 0.51
▸ PDE3A Q14432 15/20 0.51
▸ PDE4A P27815 3/20 0.49
▸ PDE4B Q07343 3/20 0.49
▸ PDE4C Q08493 3/20 0.49
▸ PDE4D Q08499 3/20 0.49
▸ GPR119 Q8TDV5 3/20 0.46
▸ F10 P00742 1/20 0.46
▸ ABCB11 O95342 1/20 0.45
▸ MAOA P21397 1/20 0.45
▸ ADORA2A P29274 1/20 0.45
▸ GALR3 O60755 1/20 0.45
▸ MAPT P10636 1/20 0.45
▸ THRB P10828 1/20 0.45

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
SCHEMBL10554632 0.84 PDE3B (0.57) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL9668103 0.79 GPR119 (0.55) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL9668844 0.79 KCNH2 (0.49) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL9667872 0.78 PDE3B (0.53) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL9781454 0.77 PDE3B (0.64) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL9781456 0.75 PDE3B (0.77) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10553008 0.75 PDE3B (0.57) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10551592 0.74 PDE3B (0.52) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10353457 0.72 PDE3B (0.71) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL9516140 0.72 PDE3B (0.57) PDE3BPDE3APDE4APDE4BPDE4C

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-0223937-B1 INDOLES SUBSTITUTED WITH HETEROCYCLES, INTERMEDIATES, PROCESS FOR THEIR PREPARATION AND MEDICAMENTS Roche Diagnostics GmbH (DE) 1992-03-18 — — EP disclosed
US-4851406-A CARDIOVASCULAR DISORDERS, HYPOTENSIVE BOEHRINGER MANNHEIM GMBH (DE) 1989-07-25 — — US disclosed
EP-0223937-A1 Indoles substituted with heterocycles, intermediates, process for their preparation and medicaments Roche Diagnostics GmbH (DE) 1987-06-03 — — EP disclosed
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