SCHEMBL10765685

SCHEMBL10765685

COc1cc(SC)c(OC)cc1C=CC1=NNC(=O)CC1C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE3A Q14432 13/20 0.43
▸ PDE3B Q13370 7/20 0.43
▸ PDE4B Q07343 7/20 0.43
▸ PDE4A P27815 1/20 0.43
▸ PDE4C Q08493 1/20 0.43
▸ PDE4D Q08499 1/20 0.43
▸ GPR119 Q8TDV5 2/20 0.36
▸ PTGS1 P23219 1/20 0.36
▸ PTGS2 P35354 1/20 0.36
▸ CYP1A1 P04798 1/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ CYP1B1 Q16678 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ NOD2 Q9HC29 1/20 0.34
▸ ABCB11 O95342 1/20 0.34
▸ MAOA P21397 1/20 0.34
▸ ADORA2A P29274 1/20 0.34
▸ HTR2A P28223 1/20 0.33
▸ MAPT P10636 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
SCHEMBL10760628 0.83 PDE3A (0.51) PDE3APDE3BPDE4BPDE4APDE4C
SCHEMBL10762914 0.83 PDE3A (0.51) PDE3APDE3BPDE4BPDE4APDE4C
SCHEMBL10764480 0.83 PDE3A (0.47) PDE3APDE3BPDE4BPDE4APDE4C
SCHEMBL10765360 0.83 PDE3A (0.45) PDE3APDE3BPDE4BPDE4APDE4C
SCHEMBL10765392 0.82 PDE3A (0.41) PDE3APDE3BPDE4BPDE4APDE4C
SCHEMBL10761339 0.81 PDE3A (0.42) PDE3APDE3BPDE4BPDE4APDE4C
SCHEMBL10763163 0.81 PDE3B (0.43) PDE3APDE3BPDE4BPDE4APDE4C
SCHEMBL10763860 0.81 PDE3B (0.44) PDE3APDE3BPDE4BPDE4APDE4C
SCHEMBL10764697 0.80 PDE3B (0.45) PDE3APDE3BPDE4BPDE4APDE4C
SCHEMBL10763623 0.80 PDE3A (0.41) PDE3APDE3BPDE4BPDE4APDE4C

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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