SCHEMBL10760273

SCHEMBL10760273

CSc1ccc(C=C(C)C2=NNC(=O)CC2C)cc1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 15/20 0.42
▸ PDE3A Q14432 15/20 0.42
▸ PBRM1 Q86U86 1/20 0.35
▸ AKR1C3 P42330 1/20 0.35
▸ AKR1C2 P52895 1/20 0.35
▸ AKR1C1 Q04828 1/20 0.35
▸ ALDH1A1 P00352 3/20 0.34
▸ PDE4A P27815 2/20 0.33
▸ PDE4B Q07343 2/20 0.33
▸ PDE4C Q08493 2/20 0.33
▸ PDE4D Q08499 2/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ LMNA P02545 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ SMN1; SMN2 Q16637 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
SCHEMBL10764873 0.86 PDE3B (0.37) PDE3BPDE3APBRM1PDE4APDE4B
SCHEMBL10761515 0.84 PDE3B (0.38) PDE3BPDE3APBRM1ALDH1A1PDE4A
SCHEMBL10766286 0.83 PDE3B (0.38) PDE3BPDE3APBRM1ALDH1A1
SCHEMBL10763441 0.82 KDM4E (0.45) PDE3BPDE3AALDH1A1PDE4APDE4B
SCHEMBL10760965 0.81 PDE3B (0.41) PDE3BPDE3APBRM1AKR1C3AKR1C2
SCHEMBL10765826 0.81 PDE3A (0.36) PDE3BPDE3AALDH1A1PDE4APDE4B
SCHEMBL10764750 0.81 PDE3B (0.41) PDE3BPDE3APBRM1ALDH1A1PDE4A
SCHEMBL10759628 0.80 PDE3A (0.42) PDE3BPDE3AALDH1A1PDE4APDE4B
SCHEMBL10761958 0.80 PDE4B (0.45) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10760114 0.80 PDE3A (0.42) 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
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