SCHEMBL7728575

SCHEMBL7728575

CCCCCC1CCC(C2CCC(c3ccc(C(=O)O)c(F)c3-c3cc(F)c(F)c(F)c3)CC2)CC1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RARB P10826 4/20 0.39
RARA P10276 3/20 0.39
RARG P13631 2/20 0.39
NOTUM Q6P988 1/20 0.34
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
DGAT1 O75907 1/20 0.33
PPARD Q03181 1/20 0.33
NFE2L2 Q16236 1/20 0.33
OPRL1 P41146 4/20 0.32
CAMKK1 Q8N5S9 2/20 0.32
CAMKK2 Q96RR4 2/20 0.32

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
SCHEMBL7728570 1.00 RARB (0.39) RARBRARARARGNOTUMMEN1
SCHEMBL7736679 0.99 RARB (0.41) RARBRARARARGNOTUMMEN1
SCHEMBL7737176 0.99 RARB (0.41) RARBRARARARGNOTUMMEN1
SCHEMBL7737171 0.99 RARB (0.41) RARBRARARARGNOTUMMEN1
SCHEMBL7736711 0.99 RARB (0.41) RARBRARARARGNOTUMMEN1
SCHEMBL7736805 0.99 RARB (0.41) RARBRARARARGNOTUMMEN1
SCHEMBL7736677 0.99 RARB (0.41) RARBRARARARGNOTUMMEN1
SCHEMBL7736734 0.99 RARB (0.41) RARBRARARARGNOTUMMEN1
SCHEMBL7736715 0.99 RARB (0.41) RARBRARARARGNOTUMMEN1
SCHEMBL7736807 0.99 RARB (0.41) RARBRARARARGNOTUMMEN1

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