SCHEMBL21834496

SCHEMBL21834496

CCOS(=O)(=O)c1ccc(C)c(-c2ccccc2)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.44
CYP3A4 P08684 2/20 0.44
CYP2C9 P11712 2/20 0.44
CYP2C19 P33261 2/20 0.44
ALDH1A1 P00352 2/20 0.43
MCOLN3 Q8TDD5 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
PTGDR2 Q9Y5Y4 1/20 0.41
CA12 O43570 2/20 0.41
CA2 P00918 2/20 0.41
CA9 Q16790 2/20 0.41
CA1 P00915 1/20 0.41
PTGS2 P35354 3/20 0.40
CYP2D6 P10635 1/20 0.39
ESR1 P03372 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.36
PIK3CD O00329 1/20 0.36
PIK3CB P42338 1/20 0.36
PIK3CG P48736 1/20 0.36
POLB P06746 1/20 0.36

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
SCHEMBL6262479 0.85 PTGS2 (0.44) PTGS2MAPTLMNA
SCHEMBL28968110 0.85 PTGS2 (0.42) L3MBTL1PTGDR2CA12CA2CA9
SCHEMBL7811520 0.83 L3MBTL1 (0.39) CYP1A2CYP3A4CYP2C9CYP2C19ALDH1A1
SCHEMBL5218987 0.80 TARBP2 (0.42) CYP1A2CYP3A4CYP2C9CYP2C19ALDH1A1
SCHEMBL28428668 0.80 MEN1 (0.42) CA12CA2CA9CA1PIK3CD
SCHEMBL6703700 0.79 TARBP2 (0.46) CYP1A2CYP3A4CYP2C9CYP2C19ALDH1A1
SCHEMBL11888408 0.79 PARL (0.53) ALDH1A1CA12CA2CA9CA1
SCHEMBL10724788 0.78 PTGDR2 (0.43) CYP1A2CYP3A4CYP2C9CYP2C19ALDH1A1
Biphenyl SCHEMBL27772108 0.78 VDR (0.45) CYP1A2CYP3A4ALDH1A1MCOLN3L3MBTL1
SCHEMBL28357540 0.77 ALDH1A1 (0.42) ALDH1A1CA2CA9CA1SMN1; SMN2

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
WO-2020066540-A1 PHOTOSENSITIVE RESIN COMPOSITION, DRY FILM, CURED PRODUCT, AND ELECTRONIC COMPONENT 太陽ホールディングス株式会社 2020-04-02 WO disclosed