SCHEMBL9490946

SCHEMBL9490946

Cc1ccc(C=[C]C=Cc2ccccc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.43
MAPT P10636 2/20 0.43
ALDH1A1 P00352 2/20 0.43
CYP1B1 Q16678 1/20 0.43
CYP3A4 P08684 1/20 0.43
NFE2L2 Q16236 4/20 0.42
PPARG P37231 1/20 0.40
TRPM8 Q7Z2W7 1/20 0.40
EGFR P00533 1/20 0.40
MMP1 P03956 1/20 0.40
MMP2 P08253 1/20 0.40
MMP9 P14780 1/20 0.40
FGF23 Q9GZV9 1/20 0.39
RELA Q04206 2/20 0.38
TRPA1 O75762 1/20 0.38
CA1 P00915 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
KDM4E B2RXH2 1/20 0.38

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
SCHEMBL397997 0.88 MAOB (0.48) MAPTALDH1A1NFE2L2TRPA1CA1
SCHEMBL11827359 0.80 TRPA1 (0.67) MAPTALDH1A1CYP1B1CYP3A4NFE2L2
SCHEMBL1239547 0.79 NFE2L2 (0.61) HPGDMAPTALDH1A1CYP1B1CYP3A4
SCHEMBL4585867 0.79 NFE2L2 (0.61) HPGDMAPTALDH1A1CYP1B1CYP3A4
SCHEMBL840358 0.79 NFE2L2 (0.61) HPGDMAPTALDH1A1CYP1B1CYP3A4
SCHEMBL7164327 0.79 NFE2L2 (0.61) HPGDMAPTALDH1A1CYP1B1CYP3A4
SCHEMBL4585859 0.79 NFE2L2 (0.61) HPGDMAPTALDH1A1CYP1B1CYP3A4
SCHEMBL700269 0.79 NFE2L2 (0.61) HPGDMAPTALDH1A1CYP1B1CYP3A4
SCHEMBL4585865 0.79 NFE2L2 (0.61) HPGDMAPTALDH1A1CYP1B1CYP3A4
SCHEMBL23458020 0.74 MAOB (0.70) HPGDMAPTALDH1A1CYP1B1CYP3A4

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-0264198-B1 OPTICAL INFORMATION RECORDING MEDIUM CANON KABUSHIKI KAISHA (JP) 1993-03-03 EP disclosed
EP-0264198-A2 Optical information recording medium CANON KABUSHIKI KAISHA (JP) 1988-04-20 EP disclosed