SCHEMBL10764535

SCHEMBL10764535

COc1ccc(C=CC2=NNC(=O)CC2C)c(S(C)(=O)=O)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 9/20 0.43
▸ PDE3A Q14432 9/20 0.43
▸ ABCB11 O95342 1/20 0.43
▸ MAOA P21397 1/20 0.43
▸ ADORA2A P29274 1/20 0.43
▸ GPR119 Q8TDV5 5/20 0.42
▸ PDE4A P27815 2/20 0.39
▸ PDE4B Q07343 2/20 0.39
▸ PDE4C Q08493 2/20 0.39
▸ PDE4D Q08499 2/20 0.39
▸ KDM4E B2RXH2 2/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ BRD4 O60885 2/20 0.37
▸ CREBBP Q92793 2/20 0.37
▸ LMNA P02545 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ ADRA2A P08913 1/20 0.35
▸ ADRA1D P25100 1/20 0.35

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
SCHEMBL10763214 0.91 PDE3B (0.43) PDE3BPDE3AABCB11MAOAADORA2A
SCHEMBL10760629 0.82 CREBBP (0.54) PDE3BPDE3AGPR119PDE4BBRD4
SCHEMBL10763860 0.81 PDE3B (0.44) PDE3BPDE3AABCB11MAOAADORA2A
SCHEMBL10761339 0.81 PDE3A (0.42) PDE3BPDE3AABCB11MAOAADORA2A
SCHEMBL10762558 0.80 PDE3A (0.44) PDE3BPDE3AABCB11MAOAADORA2A
SCHEMBL10763333 0.80 CREBBP (0.43) PDE3BPDE3AABCB11MAOAADORA2A
SCHEMBL10763829 0.80 PDE3B (0.39) PDE3BPDE3AABCB11MAOAADORA2A
SCHEMBL10762031 0.80 PDE3B (0.42) PDE3BPDE3AABCB11MAOAADORA2A
SCHEMBL10763163 0.79 PDE3B (0.43) PDE3BPDE3AABCB11MAOAADORA2A
SCHEMBL10759882 0.79 RAB9A (0.60) 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-0210530-A1 6-Arylalkenyl pyridazinones MERCK PATENT GmbH (DE) 1987-02-04 — — EP disclosed
Send feedback