SCHEMBL10014947

SCHEMBL10014947

CCCCCC1CCC(c2ccc(-c3ccc(C4CCC(COC)CC4)cc3)cc2)CC1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.43
MAPT P10636 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
MAPK1 P28482 1/20 0.41
SPHK1 Q9NYA1 11/20 0.40
GAA P10253 1/20 0.40
ESR2 Q92731 1/20 0.39
SPHK2 Q9NRA0 7/20 0.36

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
SCHEMBL16803034 0.96 CYP2C9 (0.43) CYP2C9MAPTMEN1KMT2AALDH1A1
SCHEMBL11210312 0.90 CYP2C9 (0.52) CYP2C9MAPTMEN1KMT2AALDH1A1
SCHEMBL10862270 0.90 CYP2C9 (0.52) CYP2C9MAPTMEN1KMT2AALDH1A1
SCHEMBL4803860 0.89 CYP2C9 (0.50) CYP2C9MAPTMEN1KMT2AALDH1A1
SCHEMBL4803851 0.89 CYP2C9 (0.50) CYP2C9MAPTMEN1KMT2AALDH1A1
SCHEMBL21321908 0.89 MAPT (0.44) CYP2C9MAPTMEN1KMT2AALDH1A1
SCHEMBL11190177 0.88 SPHK1 (0.50) CYP2C9MAPTMEN1KMT2AALDH1A1
SCHEMBL11191518 0.88 SPHK1 (0.50) CYP2C9MAPTMEN1KMT2AALDH1A1
SCHEMBL11190738 0.88 SPHK1 (0.50) CYP2C9MAPTMEN1KMT2AALDH1A1
SCHEMBL11191866 0.88 CYP2C9 (0.49) CYP2C9MAPTMEN1KMT2AALDH1A1

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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2883938-B1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE DAINIPPON INK & CHEMICALS (JP) 2017-10-25 EP disclosed
US-9650572-B2 Liquid crystal composition, liquid crystal display device, and liquid crystal display DIC CORPORATION (JP) 2017-05-16 US disclosed
US-20160060524-A1 LIQUID CRYSTAL COMPOSITION, LIQUID CRYSTAL DISPLAY DEVICE, AND LIQUID CRYSTAL DISPLAY DIC CORPORATION (JP) 2016-03-03 US disclosed
EP-2883938-A1 LIQUID CRYSTAL COMPOSITION, LIQUID CRYSTAL DISPLAY ELEMENT, AND LIQUID CRYSTAL DISPLAY DIC Corporation (JP) 2015-06-17 EP disclosed
US-8110256-B2 Liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2012-02-07 US disclosed
US-7842357-B2 Tetrahydropyran compound, liquid crystal, composition and liquid crystal display device containing the liquid crystal composition CHISSO CORPORATION (JP) 2010-11-30 US disclosed
US-7838087-B2 Benzene derivative, liquid crystal composition and liquid crystal display device CHISSO CORPORATION (JP) 2010-11-23 US disclosed
US-7790915-B2 Naphthalene compound with terminal hydrogen, liquid crystal composition including the compound, and LCD device including the liquid crystal composition CHISSO PETROCHEMICAL CORPORATION (JP) 2010-09-07 US disclosed
US-7749403-B2 Monofluorinated terphenyl compound having alkenyl, liquid crystal composition, and liquid crystal display device CHISSO CORPORATION (JP) 2010-07-06 US disclosed
US-20090321683-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE CHISSO CORPORATION (JP) 2009-12-31 US disclosed
US-7524540-B2 Liquid crystal composition and liquid crystal display device CHISSO CORPORATION (JP) 2009-04-28 US disclosed
US-7435455-B2 Dihydrocoumarin derivative, liquid crystal composition containing the same, and liquid crystal display device CHISSO CORPORATION (JP) 2008-10-14 US disclosed
US-7404992-B2 Liquid crystal composition and liquid crystal display device CHISSO CORPORATION (JP) 2008-07-29 US disclosed
US-7390539-B2 Liquid crystal composition and liquid crystal display device CHISSO CORPORATION (JP) 2008-06-24 US disclosed
US-20070200092-A1 Benzene Derivative, Liquid Crystal Composition And Liquid Crystal Display Device JNC PETROCHEMICAL CORPORATION (JP) 2007-08-30 US disclosed
US-7247355-B2 Liquid crystal compound having chroman ring, liquid crystal composition comprising the compound and liquid crystal display device comprising the composition CHISSO CORPORATION (JP) 2007-07-24 US disclosed
US-20070108411-A1 Liquid crystal composition and liquid crystal display device CHISSO CORPORATION 2007-05-17 US disclosed
US-20070051919-A1 NAPHTHALENE COMPOUND WITH TERMINAL HYDROGEN, LIQUID CRYSTAL COMPOSITION INCLUDING THE COMPOUND, AND LCD DEVICE INCLUDING THE LIQUID CRYSTAL COMPOSITION CHISSO PETROCHEMICAL CORPORATION (JP) 2007-03-08 US disclosed
US-20070012898-A1 Liquid crystal composition and liquid crystal display device CHISSO CORPORATION 2007-01-18 US disclosed
EP-1743930-A1 Liquid crystal composition and liquid crystal display device CHISSO CORPORATION (JP) 2007-01-17 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070051919-A1 NAPHTHALENE COMPOUND WITH TERMINAL HYDROGEN, LIQUID CRYSTAL COMPOSITION INCLUDING THE COMPOUND, AND LCD DEVICE INCLUDING THE LIQUID CRYSTAL COMPOSITION LEF1, CFD, FOXO1 CYP2C9 3113/4885MAPT 3479/4885MEN1 1518/4885
US-20070200092-A1 Benzene Derivative, Liquid Crystal Composition And Liquid Crystal Display Device CCND2, YBX1, CNKSR1 CYP2C9 3032/4885MAPT 1989/4885MEN1 3396/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.