SCHEMBL28614022

SCHEMBL28614022

CCCCCCCCCCCCc1c(CCCC)c(CCCC)c(CCCC)c(CCCC)c1S(=O)(=O)O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S1PR2 O95136 2/20 0.40
S1PR1 P21453 2/20 0.40
S1PR3 Q99500 2/20 0.40
GPR35 Q9HC97 1/20 0.39
ALOX5 P09917 9/20 0.39
MPEG1 Q2M385 7/20 0.39
XIAP P98170 2/20 0.39
GPR84 Q9NQS5 2/20 0.39
KDM4E B2RXH2 2/20 0.39
ALDH1A1 P00352 2/20 0.39
TP53 P04637 2/20 0.39
HPGD P15428 2/20 0.39
MAPK1 P28482 2/20 0.39
HSD17B10 Q99714 2/20 0.39
CYP19A1 P11511 1/20 0.39
MEN1 O00255 1/20 0.39
PTGES O14684 1/20 0.39
USP2 O75604 1/20 0.39
CYP2D6 P10635 1/20 0.39
MAPT P10636 1/20 0.39

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
SCHEMBL28412851 1.00 S1PR2 (0.40) S1PR2S1PR1S1PR3GPR35ALOX5
SCHEMBL29666514 1.00 S1PR2 (0.40) S1PR2S1PR1S1PR3GPR35ALOX5
SCHEMBL149531 0.98 S1PR2 (0.41) S1PR2S1PR1S1PR3GPR35ALOX5
SCHEMBL29666515 0.98 S1PR2 (0.41) S1PR2S1PR1S1PR3GPR35ALOX5
Ammonia Solution, Strong SCHEMBL11582308 0.96 S1PR2 (0.40) S1PR2S1PR1S1PR3GPR35ALOX5
SCHEMBL7787204 0.94 CA1 (0.38) S1PR2S1PR1S1PR3GPR35ALOX5
SCHEMBL11508708 0.94 CA2 (0.41) S1PR2S1PR1S1PR3GPR35ALOX5
SCHEMBL28580437 0.92 TYR (0.39) S1PR2S1PR1S1PR3GPR35ALOX5
SCHEMBL11508706 0.92 CYP19A1 (0.37) S1PR2S1PR1S1PR3GPR35ALOX5
SCHEMBL19137814 0.87 CA1 (0.34) S1PR2S1PR1S1PR3GPR35ALOX5

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113166390-B Thermoplastic resin for lens and lens comprising same 帝人株式会社 2023-04-04 CN disclosed
CN-110869415-B Polycarbonate copolymer 帝人株式会社 2022-06-17 CN disclosed
CN-113166390-A Thermoplastic resin for lens and lens comprising same 帝人株式会社 2021-07-23 CN disclosed