SCHEMBL7525054

SCHEMBL7525054

CCCCCC1CCC(C2CCC(C(=O)Oc3ccc(OC(F)(F)F)cc3)CC2)CC1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 5/20 0.42
▸ POLB P06746 1/20 0.42
▸ HTT P42858 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ HDAC3 O15379 1/20 0.41
▸ HDAC1 Q13547 1/20 0.41
▸ HDAC2 Q92769 1/20 0.41
▸ KDM2B Q8NHM5 1/20 0.40
▸ F2 P00734 1/20 0.40
▸ CHRM4 P08173 1/20 0.39
▸ FFAR4 Q5NUL3 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ ELANE P08246 1/20 0.39
▸ LIPE Q05469 1/20 0.38
▸ ELOVL6 Q9H5J4 1/20 0.38

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
SCHEMBL7525050 1.00 EPHX2 (0.42) EPHX2POLBHTTKMT2ASMN1; SMN2
SCHEMBL8094823 1.00 EPHX2 (0.42) EPHX2POLBHTTKMT2ASMN1; SMN2
SCHEMBL9062003 0.99 EPHX2 (0.42) EPHX2POLBHTTKMT2ASMN1; SMN2
SCHEMBL9062015 0.99 EPHX2 (0.42) EPHX2POLBHTTKMT2ASMN1; SMN2
SCHEMBL9061286 0.99 EPHX2 (0.42) EPHX2POLBHTTKMT2ASMN1; SMN2
SCHEMBL9062009 0.99 EPHX2 (0.42) EPHX2POLBHTTKMT2ASMN1; SMN2
SCHEMBL9061300 0.99 EPHX2 (0.42) EPHX2POLBHTTKMT2ASMN1; SMN2
SCHEMBL9061291 0.99 EPHX2 (0.42) EPHX2POLBHTTKMT2ASMN1; SMN2
SCHEMBL9060794 0.96 EPHX2 (0.43) EPHX2POLBHTTKMT2ASMN1; SMN2
SCHEMBL9060792 0.96 EPHX2 (0.43) EPHX2POLBHTTKMT2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0844229-B1 Polyhaloalkyl ether derivatives as well as liquid crystal compositions and liquid crystal display elements containing them CHISSO CORP (JP) 2002-02-06 — — EP disclosed
US-6166798-A TN cell having improved display of grey shades MERCK KGAA (DE) 2000-12-26 — — US disclosed
EP-0805134-B1 NOVEL LIQUID-CRYSTAL COMPOUNDS BEARING DIENYL MOIETY AND LIQUID-CRYSTAL COMPOSITION CHISSO CORP (JP) 2000-08-30 — — EP disclosed
EP-1029842-A2 Polyhaloalkyl ether derivatives as well as liquid crystal compositions and liquid crystal display elements containing them CHISSO CORPORATION (JP) 2000-08-23 — — EP 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-6007740-A USED PARTICULARLY TO LOWER THRESHOLD VOLTAGE OF LIQUID CRYSTAL COMPOSITIONS, TO ENLARGE A NEMATIC RANGE, SUCH AS INCREASE IN CLEAR POINT OF LIQUID CRYSTAL COMPOSITIONS AND CONTROL REFRACTIVE ANISOTROPIC VALUE CHISSO CORPORATION (JP) 1999-12-28 — — US disclosed
EP-0844229-A1 Polyhaloalkyl ether derivatives as well as liquid crystal compositions and liquid crystal display elements containing them CHISSO CORPORATION (JP) 1998-05-27 — — EP disclosed
CN-1169138-A Novel liquid crystal compound bearing dienyl moiety and liquid crystal composition CHISSO CORP (JP) 1997-12-31 — — CN disclosed
US-5696570-A TN cell having improved display of grey shades MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1997-12-09 — — 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-0733692-A1 Liquid crystalline compound, liquid crystal composition containing the same, and display device Chisso Corporation (JP) 1996-09-25 — — EP disclosed
US-5536442-A ELECTROOPTICS MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1996-07-16 — — US disclosed
US-5324449-A Substituted phenyl trifluoromethyl ethers MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1994-06-28 — — US disclosed
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