SCHEMBL10764414

SCHEMBL10764414

CC1CC(=O)NN=C1C=Cc1cccc(S)c1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 11/20 0.54
▸ PDE3A Q14432 11/20 0.54
▸ PTGS1 P23219 1/20 0.42
▸ PTGS2 P35354 1/20 0.42
▸ MAOB P27338 4/20 0.40
▸ PBRM1 Q86U86 1/20 0.39
▸ CREBBP Q92793 3/20 0.37
▸ BRD4 O60885 2/20 0.37
▸ PDE4A P27815 2/20 0.36
▸ PDE4B Q07343 2/20 0.36
▸ PDE4C Q08493 2/20 0.36
▸ PDE4D Q08499 2/20 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
SCHEMBL10765618 0.85 PDE3B (0.54) PDE3BPDE3APTGS1PTGS2MAOB
SCHEMBL10764454 0.85 PDE3B (0.54) PDE3BPDE3APTGS1PTGS2MAOB
SCHEMBL10764318 0.85 PDE3B (0.57) PDE3BPDE3APTGS1PTGS2MAOB
SCHEMBL10761194 0.84 PDE3B (0.65) PDE3BPDE3AMAOBPBRM1PDE4A
SCHEMBL10766164 0.82 PDE3B (0.52) PDE3BPDE3APTGS1PTGS2MAOB
SCHEMBL10767320 0.81 CREBBP (0.53) PDE3BPDE3APTGS1PTGS2MAOB
SCHEMBL10763204 0.81 PDE3B (0.51) PDE3BPDE3APTGS1PTGS2MAOB
SCHEMBL10763316 0.81 PDE3B (0.50) PDE3BPDE3APTGS1PTGS2MAOB
SCHEMBL10762047 0.79 RELA (0.56) PDE3BPDE3ACREBBPBRD4
SCHEMBL10761951 0.77 NPC1 (0.48) PDE3BPDE3APTGS1PTGS2

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-0210530-A1 6-Arylalkenyl pyridazinones MERCK PATENT GmbH (DE) 1987-02-04 — — EP disclosed
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