SCHEMBL10371893

SCHEMBL10371893

CCc1c(C=O)ccn1-c1ccc(C2=NNC(=O)CC2C)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 15/20 0.53
▸ PDE3A Q14432 15/20 0.53
▸ PDE4A P27815 2/20 0.53
▸ PDE4B Q07343 2/20 0.53
▸ PDE4C Q08493 2/20 0.53
▸ PDE4D Q08499 2/20 0.53
▸ PDE2A O00408 2/20 0.51
▸ PDE1A P54750 1/20 0.51
▸ PDE1B Q01064 1/20 0.51
▸ PDE1C Q14123 1/20 0.51
▸ HRH3 Q9Y5N1 4/20 0.44
▸ ALDH1A1 P00352 2/20 0.43
▸ MAPT P10636 2/20 0.43
▸ SLFN12 Q8IYM2 1/20 0.43
▸ KCNH2 Q12809 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ CYP2C9 P11712 1/20 0.43
▸ HPGD P15428 1/20 0.43

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
SCHEMBL10372204 0.92 PDE3B (0.51) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL11207365 0.78 PDE3B (0.60) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10353457 0.74 PDE3B (0.71) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10369906 0.74 PDE3B (0.54) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10625021 0.74 PDE3B (0.64) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10620570 0.74 PDE3B (0.63) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10371742 0.73 PDE3B (0.63) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL6212361 0.72 PDE3B (0.71) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL6212364 0.72 PDE3B (0.71) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL6212367 0.72 PDE3B (0.71) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0231744-B1 SUBSTITUTED PYRROL-1-YLPHENYLDIHYDROPYRIDAZINONES, THEIR PREPARATION AND USE BASF Aktiengesellschaft (DE) 1990-05-30 — — EP disclosed
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