SCHEMBL10759628

SCHEMBL10759628

COc1cc(SC)ccc1C=C(C)C1=NNC(=O)CC1C

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ PDE3A Q14432 10/20 0.42
▸ PDE4B Q07343 9/20 0.42
▸ PDE3B Q13370 2/20 0.42
▸ PDE4A P27815 1/20 0.42
▸ PDE4C Q08493 1/20 0.42
▸ PDE4D Q08499 1/20 0.42
▸ GPR119 Q8TDV5 4/20 0.38
▸ ABCB11 O95342 1/20 0.36
▸ MAOA P21397 1/20 0.36
▸ ADORA2A P29274 1/20 0.36
▸ MAPT P10636 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ HPGD P15428 2/20 0.34
▸ TSHR P16473 2/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ PKM P14618 1/20 0.34
▸ LMNA P02545 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
SCHEMBL10761958 0.92 PDE4B (0.45) PDE3APDE4BPDE3BPDE4APDE4C
SCHEMBL10761208 0.84 PDE3A (0.41) PDE3APDE4BPDE3BPDE4APDE4C
SCHEMBL10766451 0.82 PDE3A (0.42) PDE3APDE4BPDE3BPDE4APDE4C
SCHEMBL10765771 0.82 PDE3A (0.41) PDE3APDE4BPDE3BPDE4APDE4C
SCHEMBL10765555 0.81 PDE3A (0.42) PDE3APDE4BPDE3BPDE4APDE4C
SCHEMBL10763440 0.81 PDE3A (0.40) PDE3APDE4BPDE3BPDE4APDE4C
SCHEMBL10765744 0.80 PDE3A (0.39) PDE3APDE4BPDE3BPDE4APDE4C
SCHEMBL10760273 0.80 PDE3B (0.42) PDE3APDE4BPDE3BPDE4APDE4C
SCHEMBL10765360 0.80 PDE3A (0.45) PDE3APDE4BPDE3BPDE4APDE4C
SCHEMBL10759456 0.79 PDE3A (0.45) 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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