SCHEMBL7736720

SCHEMBL7736720

CCCCCCCC(F)Cc1c(C(=O)O)cccc1-c1cc(F)c(F)c(F)c1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RARB P10826 4/20 0.42
RARA P10276 2/20 0.42
RARG P13631 1/20 0.42
ALDH1A1 P00352 1/20 0.40
PTPN11 Q06124 4/20 0.39
LTB4R2 Q9NPC1 3/20 0.38
PTPN1 P18031 1/20 0.35
CD274 Q9NZQ7 1/20 0.35
BRS3 P32247 1/20 0.35

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
SCHEMBL7737155 1.00 RARB (0.42) RARBRARARARGALDH1A1PTPN11
SCHEMBL7728688 1.00 RARB (0.42) RARBRARARARGALDH1A1PTPN11
SCHEMBL7728743 0.99 RARB (0.40) RARBRARARARGALDH1A1PTPN11
SCHEMBL7728663 0.96 LTB4R2 (0.39) RARBRARARARGPTPN11LTB4R2
SCHEMBL7736423 0.94 LTB4R2 (0.38) RARBRARARARGPTPN11LTB4R2
SCHEMBL7736819 0.91 LTB4R2 (0.36) RARBRARARARGPTPN11LTB4R2
SCHEMBL7737258 0.91 CD274 (0.37) RARBRARARARGLTB4R2CD274
SCHEMBL7736033 0.90 CD274 (0.37) RARBRARARARGLTB4R2CD274
SCHEMBL7728334 0.89 CD274 (0.36) ALDH1A1LTB4R2CD274
SCHEMBL7728586 0.88 CD274 (0.35) RARBRARARARGLTB4R2CD274

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6468606-B1 LOW VISCOSITY, HIGH DIELECTRIC ANISOTROPY, LOW OPTICAL ANISOTROPY, EXCELLENT LOW TEMPERATURE COMPATIBILITY WITH OTHER LIQUID CRYSTALLINE COMPOUNDS; 3,4,5-TRIFLUOROPHENYL-(2-FLUORO-4-(TRANS-4-PROPYLCYCLOHEXYL))BENZOATE CHISSO CORPORATION (JP) 2002-10-22 US disclosed
EP-0808825-B1 PHENYL BENZOATE DERIVATIVES AND LIQUID CRYSTAL COMPOSITIONS CHISSO CORP (JP) 2001-09-12 EP disclosed
US-5922243-A LOW VISCOSITY, HIGH DIELECTRIC AND LOW OPTICAL ANISOTROPY, EXCELLENT COMPATIBILITY CHISSO CORPORATION (JP) 1999-07-13 US disclosed
EP-0808825-A1 PHENYL BENZOATE DERIVATIVES AND LIQUID CRYSTAL COMPOSITIONS CHISSO CORPORATION (JP) 1997-11-26 EP disclosed