SCHEMBL28910550

SCHEMBL28910550

C=COCc1ccc(C[O])cc1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.32
IDO1 P14902 2/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
APP P05067 1/20 0.31

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
SCHEMBL5479582 0.88 IDO1 (0.35) CYP3A4IDO1CA2CA9APP
SCHEMBL8456421 0.79 IDO1 (0.50) CYP3A4IDO1CA2CA9APP
SCHEMBL896480 0.79 ALDH1A1 (0.30) CYP3A4IDO1
SCHEMBL896481 0.77 AGXT (0.52) IDO1CA2CA9
SCHEMBL17592785 0.77 IDO1 (0.52) IDO1CA2CA9APP
SCHEMBL410857 0.77 IDO1 (0.52) IDO1CA2CA9APP
SCHEMBL17190074 0.77
SCHEMBL3157370 0.77 LTA4H (0.39) IDO1CA2CA9
SCHEMBL2521337 0.77 ALDH1A1 (0.50)
SCHEMBL2612240 0.77 ALDH1A1 (0.44) CYP3A4APP

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
CN-107918247-B Colored curable resin composition 住友化学株式会社 2022-03-18 CN disclosed
CN-106019840-B Colored curable resin composition 东友精细化工有限公司 2021-01-29 CN disclosed