SCHEMBL10760052

SCHEMBL10760052

COc1cc(C=CC2=NNC(=O)CC2C)ccc1O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE3B Q13370 4/20 0.56
▸ PDE3A Q14432 4/20 0.56
▸ APP P05067 8/20 0.51
▸ ALDH1A1 P00352 1/20 0.49
▸ GAA P10253 1/20 0.49
▸ MAPK1 P28482 1/20 0.49
▸ TTR P02766 1/20 0.49
▸ NFE2L2 Q16236 2/20 0.48
▸ ALOX5 P09917 3/20 0.47
▸ NFKB1 P19838 2/20 0.47
▸ STAT3 P40763 2/20 0.47
▸ NFKB2 Q00653 2/20 0.47
▸ RELA Q04206 2/20 0.47
▸ MAPT P10636 1/20 0.47
▸ MMP9 P14780 1/20 0.47
▸ ALOX12 P18054 1/20 0.47
▸ PTGS2 P35354 1/20 0.47
▸ KDR P35968 1/20 0.47
▸ PRKCE Q02156 1/20 0.47
▸ PRKCQ Q04759 1/20 0.47

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
SCHEMBL10762400 0.91 PDE3B (0.56) PDE3BPDE3AAPPALDH1A1ALOX5
SCHEMBL10766102 0.89 PDE3B (0.58) PDE3BPDE3AAPPALDH1A1TTR
SCHEMBL10764462 0.85 PDE3A (0.54) PDE3BPDE3A
SCHEMBL10762914 0.84 PDE3A (0.51) PDE3BPDE3AMAPTCYP1A2
SCHEMBL10767135 0.84 PDE3A (0.53) PDE3BPDE3AALDH1A1
SCHEMBL10766381 0.83 PDE3A (0.50) PDE3BPDE3AAPPMAPT
SCHEMBL10764747 0.83 PDE3A (0.50) PDE3BPDE3AAPPMAPT
SCHEMBL10763264 0.83 PDE3B (0.51) PDE3BPDE3AALDH1A1MAPTCYP1A2
SCHEMBL10760628 0.82 PDE3A (0.51) PDE3BPDE3AMAPT
SCHEMBL10764318 0.81 PDE3B (0.57) PDE3BPDE3APTGS2

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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