SCHEMBL7736036

SCHEMBL7736036

CCc1ccc(C(=O)O)c(F)c1-c1cc(F)c(F)c(F)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 3/20 0.43
RARA P10276 2/20 0.43
RARG P13631 1/20 0.43
AKR1C2 P52895 1/20 0.37
AKR1C1 Q04828 1/20 0.37
PPARD Q03181 1/20 0.36
LTB4R2 Q9NPC1 1/20 0.36
DCLRE1B Q9H816 2/20 0.35
ACMSD Q8TDX5 2/20 0.35
GABRP O00591 2/20 0.34
GABRD O14764 2/20 0.34
GABRA1 P14867 2/20 0.34
GABRB1 P18505 2/20 0.34
GABRG2 P18507 2/20 0.34
GABRB3 P28472 2/20 0.34
GABRA5 P31644 2/20 0.34
GABRA3 P34903 2/20 0.34
GABRA2 P47869 2/20 0.34
GABRB2 P47870 2/20 0.34
GABRA4 P48169 2/20 0.34

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
SCHEMBL7737091 0.90 RARB (0.46) RARBRARARARGAKR1C2AKR1C1
SCHEMBL7738972 0.87 RARB (0.47) RARBRARARARGMEN1KMT2A
SCHEMBL7736736 0.84 RARB (0.50) RARBRARARARGAKR1C2AKR1C1
SCHEMBL7739027 0.82 RXRA (0.36) RARBRARARARGAKR1C2AKR1C1
SCHEMBL7737127 0.82 RARB (0.45) RARBRARARARGALDH1A1RXRA
SCHEMBL7739013 0.82 RARB (0.57) RARBRARARARGAKR1C2AKR1C1
SCHEMBL7728313 0.81 RARB (0.62) RARBRARARARGMEN1KMT2A
SCHEMBL7736557 0.81 RARB (0.40) RARBRARARARGAKR1C2AKR1C1
SCHEMBL7728331 0.80 RARB (0.65) RARBRARARARGMEN1KMT2A
SCHEMBL7738943 0.80 RARB (0.65) RARBRARARARGMEN1KMT2A

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