SCHEMBL10763597

SCHEMBL10763597

C=CCS(=O)(=O)c1cccc(C=C(C)C2=NNC(=O)CC2C)c1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 6/20 0.33
▸ PDE3A Q14432 6/20 0.33
▸ PNMT P11086 1/20 0.32
▸ PBRM1 Q86U86 1/20 0.31
▸ CREBBP Q92793 3/20 0.31
▸ BRD4 O60885 2/20 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
SCHEMBL10764416 0.88 PDE3A (0.40) PDE3BPDE3APNMTPBRM1
SCHEMBL10765723 0.86 CREBBP (0.41) PDE3BPDE3APBRM1CREBBPBRD4
SCHEMBL10765539 0.85 PDE3B (0.35) PDE3BPDE3APBRM1CREBBPBRD4
SCHEMBL10766791 0.81 PDE3B (0.46) PDE3BPDE3APNMTPBRM1CREBBP
SCHEMBL10760898 0.80 PDE3B (0.37) PDE3BPDE3APNMTPBRM1CREBBP
SCHEMBL10763554 0.80 KDM4E (0.33) PDE3BPDE3APBRM1CREBBPBRD4
SCHEMBL10766176 0.79 PDE3B (0.34) PDE3BPDE3APBRM1CREBBPBRD4
SCHEMBL10767406 0.79 NPC1 (0.39) PDE3BPDE3A
SCHEMBL10763886 0.78 PDE3B (0.33) PDE3BPDE3APBRM1CREBBPBRD4
SCHEMBL10762847 0.76 GPR119 (0.43) PDE3BPDE3A

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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