SCHEMBL11020516

SCHEMBL11020516

Cc1nccn1-c1ccc(C=CC2=NNC(=O)CC2)s1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 6/20 0.49
▸ PDE3A Q14432 6/20 0.49
▸ PTGS1 P23219 3/20 0.44
▸ PTGS2 P35354 3/20 0.44
▸ LMNA P02545 4/20 0.42
▸ RAB9A P51151 3/20 0.42
▸ SMN1; SMN2 Q16637 3/20 0.42
▸ GAA P10253 2/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ POLB P06746 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ PKM P14618 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ MGAM O43451 1/20 0.37
▸ SI P14410 1/20 0.37
▸ MGAM2 Q2M2H8 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.33
▸ MAPK1 P28482 2/20 0.32
▸ CYP1A2 P05177 1/20 0.31

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
SCHEMBL11020513 1.00 PDE3B (0.49) PDE3BPDE3APTGS1PTGS2LMNA
SCHEMBL11019471 0.79 PDE3B (0.63) PDE3BPDE3APTGS1PTGS2LMNA
SCHEMBL11019458 0.79 PDE3B (0.63) PDE3BPDE3APTGS1PTGS2LMNA
SCHEMBL10726946 0.78 PDE3B (0.61) PDE3BPDE3ALMNASMN1; SMN2GAA
SCHEMBL11017552 0.78 PDE3B (0.65) PDE3BPDE3APTGS1PTGS2LMNA
SCHEMBL11017553 0.78 PDE3B (0.65) PDE3BPDE3APTGS1PTGS2LMNA
SCHEMBL10725018 0.72 ALDH1A1 (0.53) PDE3BPDE3AGAAPOLBMAPT
SCHEMBL11018454 0.70 PDE3B (0.34) PDE3BPDE3AGAAMGAMSI
SCHEMBL11018450 0.70 PDE3B (0.34) PDE3BPDE3AGAAMGAMSI
SCHEMBL10647873 0.68 PBRM1 (0.48) 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-0150463-A1 Substituted 4.5-dihydro-6-vinyl-3(2H)-pyridazinones and 6-vinyl-3(2H)-pyridazinones and process for producing the same A. Nattermann & Cie. GmbH (DE) 1985-08-07 — — EP disclosed
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