SCHEMBL7736702

SCHEMBL7736702

CC(F)CCc1c(C(=O)O)cccc1-c1cc(F)c(F)c(F)c1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CD274 Q9NZQ7 1/20 0.38
DHODH Q02127 3/20 0.38
SYK P43405 3/20 0.37
FFAR4 Q5NUL3 2/20 0.35
BRS3 P32247 2/20 0.35
ALB P02768 1/20 0.35
ACMSD Q8TDX5 1/20 0.35
ANPEP P15144 1/20 0.34
NR1I2 O75469 1/20 0.34
CYP2C9 P11712 1/20 0.34
IDO1 P14902 1/20 0.34
AKR1C2 P52895 1/20 0.34
AKR1C1 Q04828 1/20 0.34
FOLH1 Q04609 1/20 0.34
RARB P10826 2/20 0.34
POLB P06746 1/20 0.34
RARA P10276 1/20 0.34
RARG P13631 1/20 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
SCHEMBL7737092 0.87 CD274 (0.39) CD274DHODHSYKFFAR4ALB
SCHEMBL7728586 0.85 CD274 (0.35) CD274DHODHSYKFFAR4ALB
SCHEMBL7736040 0.83 CD274 (0.41) CD274DHODHSYKALBACMSD
SCHEMBL7737258 0.81 CD274 (0.37) CD274DHODHSYKBRS3ALB
SCHEMBL7736705 0.80 CD274 (0.38) CD274DHODHSYKALBACMSD
SCHEMBL7728663 0.79 LTB4R2 (0.39) CD274DHODHSYKBRS3RARB
SCHEMBL7728743 0.78 RARB (0.40) CD274DHODHBRS3RARBRARA
SCHEMBL7736033 0.78 CD274 (0.37) CD274DHODHSYKFFAR4BRS3
SCHEMBL7737257 0.78 DHODH (0.38) CD274DHODHFFAR4ALBACMSD
SCHEMBL7728584 0.78 DHODH (0.38) CD274DHODHFFAR4ALBACMSD

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