SCHEMBL20152471

SCHEMBL20152471

CCCC1CCC(c2ccc(C(=O)Oc3ccc(C#N)c(F)c3)cc2)CC1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.49
ALDH1A1 P00352 2/20 0.47
MAPT P10636 2/20 0.47
LMNA P02545 1/20 0.47
MEN1 O00255 1/20 0.42
MAPK1 P28482 1/20 0.42
KMT2A Q03164 1/20 0.42
TRPV4 Q9HBA0 1/20 0.35
TRPC3 Q13507 1/20 0.35
TRPC6 Q9Y210 1/20 0.35
GPR119 Q8TDV5 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
AOC3 Q16853 3/20 0.35
TRPA1 O75762 1/20 0.34
KDM1A O60341 3/20 0.34
FASN P49327 1/20 0.34
EGLN2 Q96KS0 2/20 0.34
NR3C2 P08235 1/20 0.33

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
SCHEMBL7910632 1.00 CYP2C9 (0.49) CYP2C9ALDH1A1MAPTLMNAMEN1
SCHEMBL5886341 1.00 CYP2C9 (0.49) CYP2C9ALDH1A1MAPTLMNAMEN1
SCHEMBL7908258 0.94 CYP2C9 (0.42) CYP2C9ALDH1A1MAPTLMNAMEN1
SCHEMBL7507632 0.94 CYP2C9 (0.42) CYP2C9ALDH1A1MAPTLMNAMEN1
SCHEMBL14300473 0.94 CYP2C9 (0.49) CYP2C9ALDH1A1MAPTLMNAMEN1
SCHEMBL13325809 0.93 CYP2C9 (0.42) CYP2C9ALDH1A1MAPTLMNAMEN1
SCHEMBL7514450 0.93 CYP2C9 (0.42) CYP2C9ALDH1A1MAPTLMNAMEN1
SCHEMBL7907223 0.93 CYP2C9 (0.42) CYP2C9ALDH1A1MAPTLMNAMEN1
SCHEMBL14526025 0.92 CYP2C9 (0.43) CYP2C9ALDH1A1MAPTLMNAMEN1
SCHEMBL7516179 0.92 CYP2C9 (0.38) CYP2C9ALDH1A1MAPTLMNAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10011773-B2 Liquid crystal display device DIC CORPORATION (JP) 2018-07-03 US disclosed
US-20180171229-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE DIC CORPORATION (JP) 2018-06-21 US disclosed
US-20180171234-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE USING THE SAME DIC CORPORATION (JP) 2018-06-21 US disclosed
US-20180134961-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE USING THE SAME DIC CORPORATION (JP) 2018-05-17 US disclosed
US-9809752-B2 Liquid crystal display device DIC CORPORATION (JP) 2017-11-07 US disclosed
US-9507185-B2 Switch element comprising a liquid crystalline medium MERCK PATENT GMBH (DE) 2016-11-29 US disclosed
US-9410086-B2 Liquid crystal-polymer composite material DIC CORPORATION (JP) 2016-08-09 US disclosed
US-9410086-B2 Liquid crystal-polymer composite material DIC CORPORATION (JP) 2016-08-09 US disclosed
US-20160215217-A1 LIQUID CRYSTAL DISPLAY DEVICE DIC CORPORATION (JP) 2016-07-28 US disclosed
US-20160215217-A1 LIQUID CRYSTAL DISPLAY DEVICE DIC CORPORATION (JP) 2016-07-28 US disclosed
US-8252202-B2 Nematic liquid crystal composition and bistable nematic liquid crystal display DIC CORPORATION (JP) 2012-08-28 US disclosed
US-20110211148-A1 NEMATIC LIQUID CRYSTAL COMPOSITION AND BISTABLE NEMATIC LIQUID CRYSTAL DISPLAY DIC CORPORATION (JP) 2011-09-01 US disclosed
WO-2010145211-A1 LIQUID FLUORESCENT COMPOSITION AND LIGHT EMITTING DEVICE INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (CN) 2010-12-23 WO disclosed
US-20100201930-A1 NEMATIC LIQUID CRYSTAL COMPOSITION AND BISTABLE NEMATIC LIQUD CRYSTAL DISPLAY DIC CORPORATION (JP) 2010-08-12 US disclosed
US-7622056-B2 High dielectric anisotropy liquid crystal compound and composition containing the same INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2009-11-24 US disclosed
US-20080135803-A1 High dielectric anisotropy liquid crystal compound and composition containing the same INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE DAILY POLYMER CORPORATION 2008-06-12 US disclosed
US-7294368-B2 Liquid crystal composition for use in bistable liquid crystal devices MERCK PATENT GMBH (DE) 2007-11-13 US disclosed
US-7258903-B2 Fast switching liquid crystal compositions for use in bistable liquid crystal devices MERCK PATENT GMBH (DE) 2007-08-21 US disclosed
US-7198827-B1 Nematic liquid crystal composition and liquid crystal display device using the same DAINIPPON INK AND CHEMICALS, INC. (JP) 2007-04-03 US disclosed
US-7198827-B1 Nematic liquid crystal composition and liquid crystal display device using the same DAINIPPON INK AND CHEMICALS, INC. (JP) 2007-04-03 US 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 (1 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-20080135803-A1 High dielectric anisotropy liquid crystal compound and composition containing the same KIF23, PIEZO1, KIFC1 CYP2C9 1643/4885ALDH1A1 3546/4885MAPT 72/4885

“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.