SCHEMBL10765392

SCHEMBL10765392

COc1cc(C=CC2=NNC(=O)CC2C)c(OC)c(OC)c1SC

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PDE3A Q14432 15/20 0.41
▸ PDE4B Q07343 9/20 0.41
▸ PDE3B Q13370 8/20 0.41
▸ PDE4A P27815 2/20 0.41
▸ PDE4C Q08493 2/20 0.41
▸ PDE4D Q08499 2/20 0.41
▸ GPR119 Q8TDV5 2/20 0.37
▸ PTGS1 P23219 1/20 0.34
▸ PTGS2 P35354 1/20 0.34
▸ ABCB11 O95342 1/20 0.33
▸ MAOA P21397 1/20 0.33
▸ ADORA2A P29274 1/20 0.33
▸ MAPT P10636 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL10766386 0.84 PDE3A (0.48) PDE3APDE4BPDE3BPDE4APDE4C
SCHEMBL10765685 0.82 PDE3A (0.43) PDE3APDE4BPDE3BPDE4APDE4C
SCHEMBL10765644 0.82 PDE3A (0.41) PDE3APDE4BPDE3BPDE4APDE4C
SCHEMBL10764456 0.81 PTGS1 (0.45) PDE3APDE4BPDE3BPDE4APDE4C
SCHEMBL10760532 0.81 PDE3A (0.40) PDE3APDE4BPDE3BPDE4APDE4C
SCHEMBL10767048 0.80 PDE3A (0.39) PDE3APDE4BPDE3BPDE4APDE4C
SCHEMBL10765744 0.80 PDE3A (0.39) PDE3APDE4BPDE3BPDE4APDE4C
SCHEMBL10765360 0.79 PDE3A (0.45) PDE3APDE4BPDE3BPDE4APDE4C
SCHEMBL10764480 0.79 PDE3A (0.47) PDE3APDE4BPDE3BPDE4APDE4C
SCHEMBL10762602 0.79 PTGS2 (0.58) PDE3APDE4BPDE3BPDE4APDE4C

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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