SCHEMBL10761240

SCHEMBL10761240

CSc1ccc(C=CC2=NNC(=O)CC2C)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 8/20 0.62
▸ PDE3A Q14432 8/20 0.62
▸ CYP1A1 P04798 4/20 0.39
▸ CYP1A2 P05177 4/20 0.39
▸ CYP1B1 Q16678 4/20 0.39
▸ PBRM1 Q86U86 1/20 0.37
▸ LMNA P02545 4/20 0.37
▸ RAB9A P51151 4/20 0.37
▸ ALDH1A1 P00352 2/20 0.37
▸ KDM4E B2RXH2 2/20 0.37
▸ POLB P06746 2/20 0.37
▸ MAPT P10636 2/20 0.37
▸ HPGD P15428 1/20 0.37
▸ FBP1 P09467 1/20 0.37
▸ SMN1; SMN2 Q16637 3/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ PDE4A P27815 1/20 0.35
▸ PDE4B Q07343 1/20 0.35
▸ PDE4C Q08493 1/20 0.35
▸ PDE4D Q08499 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
SCHEMBL10766164 0.85 PDE3B (0.52) PDE3BPDE3ACYP1A1CYP1A2CYP1B1
SCHEMBL10761737 0.85 PDE3B (0.67) PDE3BPDE3APBRM1LMNARAB9A
SCHEMBL10761194 0.83 PDE3B (0.65) PDE3BPDE3APBRM1LMNARAB9A
SCHEMBL10765163 0.83 PDE3B (0.65) PDE3BPDE3APBRM1LMNARAB9A
SCHEMBL10759796 0.83 PDE3B (0.69) PDE3BPDE3APBRM1LMNARAB9A
SCHEMBL7285568 0.83 PDE3B (0.65) PDE3BPDE3APBRM1LMNARAB9A
SCHEMBL10761216 0.83 PDE3B (0.65) PDE3BPDE3APBRM1LMNARAB9A
SCHEMBL10765188 0.83 PDE3B (0.56) PDE3BPDE3APBRM1LMNARAB9A
SCHEMBL10765802 0.82 PDE3B (0.55) PDE3BPDE3APBRM1LMNARAB9A
SCHEMBL10767384 0.81 PDE3B (0.62) PDE3BPDE3ALMNARAB9AALDH1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0210530-A1 6-Arylalkenyl pyridazinones MERCK PATENT GmbH (DE) 1987-02-04 — — EP claimed
EP-0210530-A1 6-Arylalkenyl pyridazinones MERCK PATENT GmbH (DE) 1987-02-04 — — EP disclosed
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