SCHEMBL7516262

SCHEMBL7516262

CCCCCc1ccc(C(=O)O)c(-c2ccc(C#N)c(F)c2)c1

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RARB P10826 11/20 0.60
RARA P10276 3/20 0.60
RARG P13631 1/20 0.60
PPARA Q07869 2/20 0.49
PPARG P37231 1/20 0.46
KAT8 Q9H7Z6 2/20 0.46
AGTR1 P30556 1/20 0.43
AGTR2 P50052 1/20 0.43
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 1/20 0.42
MAPT P10636 1/20 0.42
MTOR P42345 1/20 0.42
KMT2A Q03164 1/20 0.42
SLC22A12 Q96S37 1/20 0.42
MCL1 Q07820 1/20 0.41
LTB4R2 Q9NPC1 1/20 0.41

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
SCHEMBL4651808 0.97 RARB (0.55) RARBRARARARGPPARAPPARG
SCHEMBL7511320 0.92 RARB (0.48) RARBRARARARGSLC22A12MCL1
SCHEMBL6267138 0.87 RARB (0.44) RARBRARARARGSLC22A12
SCHEMBL8036183 0.86 RARB (0.48) RARBRARARARGALDH1A1MCL1
SCHEMBL8036065 0.85 RARB (0.52) RARBRARARARGALDH1A1MCL1
SCHEMBL4650767 0.84 RARB (0.55) RARBRARARARGPPARAKAT8
SCHEMBL8048282 0.83 S1PR1 (0.42) RARBRARARARGSLC22A12
SCHEMBL8049055 0.83 RARB (0.43) RARBRARARARGSLC22A12MCL1
SCHEMBL6267448 0.82 TSHR (0.58) RARBRARARARGPPARAPPARG
SCHEMBL9192514 0.82 SLC22A12 (0.40) RARBRARARARGSLC22A12

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0742275-B1 LIQUID CRYSTAL COMPOUND AND LIQUID CRYSTAL COMPOSITION CONTAINING THE SAME CHISSO CORP (JP) 2002-03-20 EP disclosed
EP-0805134-B1 NOVEL LIQUID-CRYSTAL COMPOUNDS BEARING DIENYL MOIETY AND LIQUID-CRYSTAL COMPOSITION CHISSO CORP (JP) 2000-08-30 EP disclosed
US-6086964-A Liquid crystalline compound having dienyl moiety and liquid crystal composition CHISSO CORPORATION (JP) 2000-07-11 US disclosed
EP-0733692-B1 Liquid crystalline compound, liquid crystal composition containing the same, and display device CHISSO CORP (JP) 2000-06-14 EP disclosed
US-6001275-A LIQUID CRYSTALLINE COMPOUND WHICH HAS A LARGE RATIO OF ELASTIC CONSTANTS, HAS A LOW VISCOSITY, EXCELLENT MISCIBILITY WITH OTHER LIQUID CRYSTALLINE COMPOUND, CHEMICALLY STABLE; HAVING AN UNCONJUGATED ALKADIENYL GROUP AT A SIDE CHAIN. CHISSO CORPORATION (JP) 1999-12-14 US disclosed
US-5833879-A LOW TEMPERATURE MISCIBILITY AND COMPATIBILITY WITH OTHER LIQUID CRYSTAL COMPOUNDS; DISPLAYS CONTAINING MIXTURES OF AT LEAST TWO COMPOUNDS, PHYSICAL PROPERTIES CHISSO CORPORATION (JP) 1998-11-10 US disclosed
EP-0805134-A1 NOVEL LIQUID-CRYSTAL COMPOUNDS BEARING DIENYL MOIETY AND LIQUID-CRYSTAL COMPOSITION CHISSO CORPORATION (JP) 1997-11-05 EP disclosed
EP-0742275-A1 LIQUID CRYSTAL COMPOUND AND LIQUID CRYSTAL COMPOSITION CONTAINING THE SAME CHISSO CORPORATION (JP) 1996-11-13 EP disclosed
US-5454975-A Electrooptical display MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1995-10-03 US disclosed