SCHEMBL10339668

SCHEMBL10339668

CCCCCCC[C@H]1CC[C@H](COc2ccc(-c3ccc(CCCCC)cc3)cc2F)CC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 8/20 0.48
RARA P10276 2/20 0.48
RARG P13631 1/20 0.48
S1PR1 P21453 1/20 0.42
TSHR P16473 1/20 0.40
HSD17B10 Q99714 1/20 0.40
PPARD Q03181 3/20 0.39
FFAR1 O14842 2/20 0.39
TLR9 Q9NR96 1/20 0.38
TLR8 Q9NR97 1/20 0.38
TLR7 Q9NYK1 1/20 0.38
FFAR4 Q5NUL3 2/20 0.38
PPARA Q07869 1/20 0.38
ITGB3 P05106 1/20 0.37
ITGA2B P08514 1/20 0.37
MEN1 O00255 1/20 0.37
ALDH1A1 P00352 1/20 0.37
MAPT P10636 1/20 0.37
MTOR P42345 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL10339667 1.00 RARB (0.48) RARBRARARARGS1PR1TSHR
SCHEMBL9195758 0.96 RARB (0.43) RARBRARARARGS1PR1TSHR
SCHEMBL9190410 0.96 RARB (0.43) RARBRARARARGS1PR1TSHR
SCHEMBL9195376 0.96 RARB (0.43) RARBRARARARGS1PR1TSHR
SCHEMBL9195375 0.96 RARB (0.43) RARBRARARARGS1PR1TSHR
SCHEMBL9195856 0.96 RARB (0.43) RARBRARARARGS1PR1TSHR
SCHEMBL10435295 0.96 RARB (0.43) RARBRARARARGS1PR1TSHR
SCHEMBL10435287 0.96 RARB (0.43) RARBRARARARGS1PR1TSHR
SCHEMBL9195761 0.96 RARB (0.43) RARBRARARARGS1PR1TSHR
SCHEMBL9195852 0.96 RARB (0.43) RARBRARARARGS1PR1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2247146-A None JP disclosed
JP-H02247146-A TRICYCLIC COMPOUND HAVING OXYMETHYLENE BOND DAINIPPON INK & CHEM INC 1990-10-02 JP disclosed