SCHEMBL28817060

SCHEMBL28817060

O=C(OC1OO1)C1(C(=O)OC2OO2)CCCCC1

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.32
MAPT P10636 1/20 0.32
CYP2C19 P33261 1/20 0.32
ALDH1A1 P00352 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL27533529 0.83 NPSR1 (0.31) NPSR1MAPTCYP2C19
SCHEMBL9485096 0.74 CYP2C19 (0.52) MAPTCYP2C19
SCHEMBL5493739 0.74 CYP2C19 (0.52) MAPTCYP2C19
SCHEMBL28523883 0.74 MAPT (0.33) MAPTCYP2C19
SCHEMBL4870814 0.72 NPSR1 (0.52) NPSR1MAPTCYP2C19ALDH1A1L3MBTL1
SCHEMBL9806699 0.72 NPSR1 (0.52) NPSR1MAPTCYP2C19ALDH1A1L3MBTL1
SCHEMBL594374 0.72 NPSR1 (0.52) NPSR1MAPTCYP2C19ALDH1A1L3MBTL1
SCHEMBL6354331 0.70 MEN1 (0.33) MAPTCYP2C19
SCHEMBL16086274 0.70 CYP2C19 (0.47) MAPTCYP2C19
SCHEMBL11647943 0.69 NPSR1 (0.33) NPSR1CYP2C19

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
CN-109696800-B Colored photosensitive resin composition, pattern layer, color filter and display device 东友精细化工有限公司 2022-07-22 CN disclosed