SCHEMBL31410813

SCHEMBL31410813

CCCCCCCCCCc1cc(Cl)sc1Cl

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 4/20 0.42
TYR P14679 2/20 0.42
CYP3A4 P08684 2/20 0.42
MEN1 O00255 1/20 0.42
TP53 P04637 1/20 0.42
MAPT P10636 1/20 0.42
ALOX15 P16050 1/20 0.42
TSHR P16473 1/20 0.42
HTT P42858 1/20 0.42
KMT2A Q03164 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
LIPG Q9Y5X9 1/20 0.39
GPR35 Q9HC97 1/20 0.39
PTGS2 P35354 6/20 0.38
KAT2B Q92831 1/20 0.36
HTR2A P28223 1/20 0.36
GPR3 P46089 1/20 0.36
CYSLTR2 Q9NS75 2/20 0.36
CYSLTR1 Q9Y271 2/20 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
SCHEMBL19304364 1.00 ALOX5 (0.42) ALOX5TYRCYP3A4MEN1TP53
SCHEMBL198015 1.00 ALOX5 (0.42) ALOX5TYRCYP3A4MEN1TP53
SCHEMBL2854857 1.00 ALOX5 (0.42) ALOX5TYRCYP3A4MEN1TP53
SCHEMBL30603823 0.86 ALOX5 (0.41) ALOX5TYRCYP3A4MEN1TP53
SCHEMBL2847218 0.83 TYR (0.42) ALOX5TYRCYP3A4MEN1TP53
SCHEMBL2845020 0.83 ALOX5 (0.42) ALOX5TYRCYP3A4MEN1TP53
SCHEMBL2855414 0.83 ALOX5 (0.39) ALOX5TYRCYP3A4MEN1TP53
SCHEMBL3423745 0.83 TYR (0.42) ALOX5TYRCYP3A4MEN1TP53
SCHEMBL2847214 0.83 ALOX5 (0.39) ALOX5TYRCYP3A4MEN1TP53
SCHEMBL2848954 0.83 ALOX5 (0.42) ALOX5TYRCYP3A4MEN1TP53

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-119400861-A Composite organic electrode material, preparation method and application 湖南省正源储能材料与器件研究所 2025-02-07 CN disclosed