SCHEMBL7737098

SCHEMBL7737098

CCCCC1CCC(C2CCC(c3cc(F)c(C(=O)O)c(F)c3-c3cc(F)c(F)c(F)c3)CC2)CC1

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.34
OPRL1 P41146 2/20 0.33
TP53 P04637 4/20 0.32
POLB P06746 1/20 0.32
SCN9A Q15858 1/20 0.32
NAAA Q02083 1/20 0.31
DGAT1 O75907 1/20 0.31

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
SCHEMBL7737094 1.00 MAPT (0.34) MAPTOPRL1TP53POLBSCN9A
SCHEMBL7737151 0.97 OPRL1 (0.33) MAPTOPRL1TP53POLBSCN9A
SCHEMBL7737154 0.97 OPRL1 (0.33) MAPTOPRL1TP53POLBSCN9A
SCHEMBL7736492 0.97 MAPT (0.36) MAPTOPRL1TP53POLBSCN9A
SCHEMBL7736491 0.97 MAPT (0.36) MAPTOPRL1TP53POLBSCN9A
SCHEMBL7736042 0.96 RARB (0.33) MAPTOPRL1TP53SCN9A
SCHEMBL7736727 0.96 RARB (0.33) MAPTOPRL1TP53SCN9A
SCHEMBL7737145 0.96 RARB (0.33) MAPTOPRL1TP53SCN9A
SCHEMBL7738937 0.96 RARB (0.33) MAPTOPRL1TP53SCN9A
SCHEMBL7736534 0.96 RARB (0.33) MAPTOPRL1TP53SCN9A

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