SCHEMBL28807898

SCHEMBL28807898

CCCCCCCCCCCCCCCCC(Cc1ccc(C(C)C)cc1)C(=O)O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FOLH1 Q04609 2/20 0.48
▸ ALOX5 P09917 4/20 0.46
▸ PTGES O14684 3/20 0.46
▸ PPARG P37231 3/20 0.46
▸ PPARA Q07869 1/20 0.46
▸ GRIK1 P39086 2/20 0.45
▸ GRIK2 Q13002 2/20 0.45
▸ EPHX1 P07099 1/20 0.45
▸ PTGS1 P23219 3/20 0.44
▸ PTGS2 P35354 3/20 0.44
▸ LMNA P02545 2/20 0.44
▸ CYP2C9 P11712 2/20 0.44
▸ AKR1C3 P42330 2/20 0.44
▸ CXCR1 P25024 2/20 0.44
▸ CXCR2 P25025 2/20 0.44
▸ ALB P02768 1/20 0.44
▸ ESR1 P03372 1/20 0.44
▸ RARB P10826 1/20 0.44
▸ ADRB3 P13945 1/20 0.44
▸ NFKB1 P19838 1/20 0.44

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
SCHEMBL4811047 0.87 FOLH1 (0.47) FOLH1ALOX5PTGESPPARGPPARA
SCHEMBL28947373 0.87 PPARA (0.55) FOLH1ALOX5PTGESPPARGPPARA
SCHEMBL28807919 0.87 PPARA (0.55) FOLH1ALOX5PTGESPPARGPPARA
SCHEMBL28807881 0.87 PPARA (0.55) FOLH1ALOX5PTGESPPARGPPARA
SCHEMBL28807890 0.87 PPARA (0.55) FOLH1ALOX5PTGESPPARGPPARA
SCHEMBL28223654 0.85 PTGES (0.50) FOLH1ALOX5PTGESPPARGPPARA
SCHEMBL5326614 0.85 ESR1 (0.50) FOLH1ALOX5PTGESPPARGPPARA
SCHEMBL7768894 0.85 PTGES (0.50) FOLH1ALOX5PTGESPPARGPPARA
SCHEMBL9209348 0.84 FOLH1 (0.66) FOLH1ALOX5PTGESPPARGCPA3
SCHEMBL9653480 0.84 FOLH1 (0.66) FOLH1ALOX5PTGESPPARGCPA3

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-108329746-B Compounds for reducing background color in color change compositions 西甘产业股份有限公司 2022-08-02 — — CN disclosed
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