SCHEMBL28435007

SCHEMBL28435007

CCCCc1cc(O)ccc1CC(C(=O)Oc1ccc(O)cc1CCCC)(c1ccc(O)cc1CCCC)c1ccc(O)cc1CCCC

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TYR P14679 2/20 0.43
ALOX5 P09917 3/20 0.38
MEN1 O00255 1/20 0.38
TP53 P04637 1/20 0.38
CYP3A4 P08684 1/20 0.38
MAPT P10636 1/20 0.38
ALOX15 P16050 1/20 0.38
TSHR P16473 1/20 0.38
HTT P42858 1/20 0.38
KMT2A Q03164 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
CNR2 P34972 10/20 0.36
CNR1 P21554 8/20 0.36
ELANE P08246 1/20 0.35
ALDH1A1 P00352 1/20 0.35
GAA P10253 1/20 0.35
ERAP1 Q9NZ08 1/20 0.35
PTGS2 P35354 1/20 0.33

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
SCHEMBL2705413 0.77 TYR (0.50) TYRALOX5MEN1TP53CYP3A4
SCHEMBL29538306 0.77 TYR (0.50) TYRALOX5MEN1TP53CYP3A4
SCHEMBL27306758 0.76 TYR (0.51) TYRALOX5MEN1TP53CYP3A4
SCHEMBL11803854 0.72 TYR (0.47) TYRALOX5MEN1TP53CYP3A4
SCHEMBL19335348 0.72 ELANE (0.49) CYP3A4ELANEALDH1A1
SCHEMBL27293376 0.71 CNR2 (0.55) TYRALOX5MEN1TP53CYP3A4
SCHEMBL19453933 0.70 TYR (0.69) TYRALOX5MEN1TP53CYP3A4
SCHEMBL9339634 0.70 TYR (0.74) TYRALOX5MEN1TP53CYP3A4
SCHEMBL10903132 0.70 TYR (0.51) TYRALOX5MEN1TP53CYP3A4
SCHEMBL466219 0.69 ALOX5 (0.58) TYRALOX5MEN1TP53CYP3A4

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-107250209-B Polycarbonate and liquid crystalline polymer blends 沙特基础工业全球技术公司 2020-06-26 CN disclosed