SCHEMBL7737154

SCHEMBL7737154

CCCCCC1CCC(C2CCC(c3cc(F)c(C(=O)O)c(F)c3-c3cc(F)c(F)c(F)c3)CC2)CC1

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 2/20 0.33
MAPT P10636 4/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
CCR2 P41597 1/20 0.32
SCN9A Q15858 1/20 0.32
RARB P10826 2/20 0.31
RARA P10276 1/20 0.31
RARG P13631 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
TP53 P04637 2/20 0.30
DGAT1 O75907 1/20 0.30
POLB P06746 1/20 0.30
GAA P10253 1/20 0.30

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
SCHEMBL7737151 1.00 OPRL1 (0.33) OPRL1MAPTMEN1KMT2ACCR2
SCHEMBL7736723 0.99 RARB (0.33) OPRL1MAPTMEN1KMT2ACCR2
SCHEMBL7737145 0.99 RARB (0.33) OPRL1MAPTMEN1KMT2ACCR2
SCHEMBL7737140 0.99 RARB (0.33) OPRL1MAPTMEN1KMT2ACCR2
SCHEMBL7736534 0.99 RARB (0.33) OPRL1MAPTMEN1KMT2ACCR2
SCHEMBL7736042 0.99 RARB (0.33) OPRL1MAPTMEN1KMT2ACCR2
SCHEMBL7736727 0.99 RARB (0.33) OPRL1MAPTMEN1KMT2ACCR2
SCHEMBL7738937 0.99 RARB (0.33) OPRL1MAPTMEN1KMT2ACCR2
SCHEMBL7736537 0.99 RARB (0.33) OPRL1MAPTMEN1KMT2ACCR2
SCHEMBL7736044 0.99 RARB (0.33) OPRL1MAPTMEN1KMT2ACCR2

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