SCHEMBL8678083

SCHEMBL8678083

CCCCc1c(C(=O)O)cccc1-c1ccc(C#N)c(F)c1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LTB4R2 Q9NPC1 2/20 0.43
RARB P10826 2/20 0.43
RARA P10276 1/20 0.43
RARG P13631 1/20 0.43
LTB4R Q15722 1/20 0.41
MCL1 Q07820 1/20 0.41
PTPN11 Q06124 1/20 0.40
SLC22A12 Q96S37 1/20 0.40
CYP2C9 P11712 1/20 0.39
S1PR1 P21453 1/20 0.39
SYK P43405 1/20 0.39
CD274 Q9NZQ7 1/20 0.39
CYP11B1 P15538 1/20 0.39
CYP11B2 P19099 1/20 0.39
APLNR P35414 2/20 0.39
BRS3 P32247 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
SCHEMBL8678448 0.97 RARB (0.47) LTB4R2RARBRARARARGLTB4R
SCHEMBL8676486 0.93 SYK (0.45) LTB4R2RARBRARARARGLTB4R
SCHEMBL8678897 0.89 SYK (0.43) LTB4R2SLC22A12CYP2C9S1PR1SYK
SCHEMBL9192052 0.83 CYP11B2 (0.37) SLC22A12CD274CYP11B1CYP11B2
SCHEMBL4650767 0.82 RARB (0.55) LTB4R2RARBRARARARGBRS3
SCHEMBL11753978 0.81 LTB4R2 (0.53) LTB4R2LTB4RBRS3
SCHEMBL4651808 0.81 RARB (0.55) LTB4R2RARBRARARARGMCL1
SCHEMBL14919189 0.78 TSHR (0.43)
SCHEMBL9514700 0.78 LTB4R2 (0.53) LTB4R2RARBPTPN11BRS3
SCHEMBL7516262 0.78 RARB (0.60) LTB4R2RARBRARARARGMCL1

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
US-5720899-A Liquid crystalline compound, liquid crystal composition and liquid crystal display element CHISSO CORPORATION (JP) 1998-02-24 US disclosed