SCHEMBL10765905

SCHEMBL10765905

C=CC[S+]([O-])c1ccc(C=C(C)C2=NNC(=O)CC2C)cc1

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 12/20 0.38
▸ PDE3A Q14432 12/20 0.38
▸ PBRM1 Q86U86 1/20 0.31
▸ BRD4 O60885 1/20 0.31
▸ CREBBP Q92793 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
SCHEMBL10763886 0.88 PDE3B (0.33) PDE3BPDE3APBRM1BRD4CREBBP
SCHEMBL10764750 0.85 PDE3B (0.41) PDE3BPDE3APBRM1BRD4CREBBP
SCHEMBL10766074 0.83 PDE3A (0.40) PDE3BPDE3A
SCHEMBL10764091 0.82 PDE3B (0.39) PDE3BPDE3APBRM1BRD4CREBBP
SCHEMBL10765377 0.81 PDE3B (0.32) PDE3BPDE3APBRM1BRD4CREBBP
SCHEMBL10764416 0.81 PDE3A (0.40) PDE3BPDE3APBRM1
SCHEMBL10761085 0.81 PDE3B (0.54) PDE3BPDE3APBRM1
SCHEMBL10763162 0.80 GPR119 (0.41) PDE3BPDE3A
SCHEMBL10761515 0.80 PDE3B (0.38) PDE3BPDE3APBRM1
SCHEMBL10760965 0.78 PDE3B (0.41) PDE3BPDE3APBRM1

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
Send feedback