SCHEMBL10763333

SCHEMBL10763333

COc1c(C=CC2=NNC(=O)CC2C)cccc1S(C)(=O)=O

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CREBBP Q92793 4/20 0.43
▸ BRD4 O60885 4/20 0.43
▸ PDE3B Q13370 9/20 0.43
▸ PDE3A Q14432 9/20 0.43
▸ PDE4A P27815 2/20 0.37
▸ PDE4B Q07343 2/20 0.37
▸ PDE4C Q08493 2/20 0.37
▸ PDE4D Q08499 2/20 0.37
▸ PTGS1 P23219 1/20 0.37
▸ PTGS2 P35354 1/20 0.37
▸ GPR119 Q8TDV5 3/20 0.34
▸ PBRM1 Q86U86 1/20 0.34
▸ ABCB11 O95342 1/20 0.33
▸ MAOA P21397 1/20 0.33
▸ ADORA2A P29274 1/20 0.33
▸ MAOB P27338 1/20 0.33

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
SCHEMBL10760629 0.86 CREBBP (0.54) CREBBPBRD4PDE3BPDE3APDE4B
SCHEMBL10764086 0.84 PTGS1 (0.47) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10764292 0.83 PDE3A (0.43) CREBBPBRD4PDE3BPDE3APDE4A
SCHEMBL10767466 0.83 PTGS1 (0.44) CREBBPBRD4PDE3BPDE3APDE4A
SCHEMBL10763566 0.81 PDE3A (0.43) CREBBPBRD4PDE3BPDE3APDE4A
SCHEMBL10764535 0.80 PDE3B (0.43) CREBBPBRD4PDE3BPDE3APDE4A
SCHEMBL10763214 0.80 PDE3B (0.43) CREBBPBRD4PDE3BPDE3APDE4A
SCHEMBL10761913 0.80 BRD4 (0.35) CREBBPBRD4PDE3BPDE3APDE4A
SCHEMBL10768128 0.80 PDE3B (0.39) CREBBPBRD4PDE3BPDE3APDE4A
SCHEMBL10763120 0.80 PDE3A (0.42) CREBBPBRD4PDE3BPDE3APDE4A

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