SCHEMBL7516179

SCHEMBL7516179

CCC1CCC(c2ccc(C(=O)Oc3ccc(C#N)c(F)c3)cc2)CC1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.38
ALDH1A1 P00352 3/20 0.37
MAPT P10636 2/20 0.37
LMNA P02545 1/20 0.37
TRPV4 Q9HBA0 1/20 0.36
TRPC3 Q13507 1/20 0.36
TRPC6 Q9Y210 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
AOC3 Q16853 2/20 0.35
FASN P49327 1/20 0.35
EGLN2 Q96KS0 2/20 0.35
GPR119 Q8TDV5 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
NR3C2 P08235 1/20 0.34
KDM1A O60341 2/20 0.33
TRPA1 O75762 1/20 0.33
MCHR1 Q99705 1/20 0.33
KMT2A Q03164 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
SCHEMBL8451896 1.00 CYP2C9 (0.38) CYP2C9ALDH1A1MAPTLMNATRPV4
SCHEMBL20152468 1.00 CYP2C9 (0.38) CYP2C9ALDH1A1MAPTLMNATRPV4
SCHEMBL20152471 0.92 CYP2C9 (0.49) CYP2C9ALDH1A1MAPTLMNATRPV4
SCHEMBL5886341 0.92 CYP2C9 (0.49) CYP2C9ALDH1A1MAPTLMNATRPV4
SCHEMBL7910632 0.92 CYP2C9 (0.49) CYP2C9ALDH1A1MAPTLMNATRPV4
SCHEMBL10779799 0.91 TRPV4 (0.36) CYP2C9ALDH1A1MAPTLMNATRPV4
SCHEMBL8046374 0.91 TRPV4 (0.36) CYP2C9ALDH1A1MAPTLMNATRPV4
SCHEMBL10780470 0.91 ALDH1A1 (0.38) CYP2C9ALDH1A1MAPTLMNATRPV4
SCHEMBL10780478 0.91 ALDH1A1 (0.38) CYP2C9ALDH1A1MAPTLMNATRPV4
SCHEMBL6452687 0.90 TRPV4 (0.35) CYP2C9ALDH1A1MAPTLMNATRPV4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11174431-B2 Liquid crystal composition and liquid crystal display device DIC CORPORATION (JP) 2021-11-16 US disclosed
US-10975304-B2 Liquid crystal composition and liquid crystal display device using the same DIC CORPORATION (JP) 2021-04-13 US disclosed
US-10913896-B2 Liquid crystal composition and liquid crystal display device using the same DIC CORPORATION (JP) 2021-02-09 US disclosed
US-10752838-B2 Liquid crystal composition and liquid crystal display device using the same DIC CORPORATION (JP) 2020-08-25 US disclosed
US-10011773-B2 Liquid crystal display device DIC CORPORATION (JP) 2018-07-03 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-20180171234-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE USING THE SAME DIC CORPORATION (JP) 2018-06-21 US disclosed
US-20180171229-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE 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-20180134961-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE USING THE SAME DIC CORPORATION (JP) 2018-05-17 US disclosed
EP-0597701-B1 Conjugated enyne derivative and liquid crystal composition CHISSO CORP (JP) 1997-04-16 EP disclosed
CN-1140160-A Liquid crystalline compound having conjugated carbon chain and liquid crystal composition containing the same CHISSO CORP (JP) 1997-01-15 CN disclosed
CN-1140194-A Liquid crystalline compound having branched alkyl group at its side chain and liquid crystal composition containing the same CHISSO CORP (JP) 1997-01-15 CN disclosed
EP-0742275-A1 LIQUID CRYSTAL COMPOUND AND LIQUID CRYSTAL COMPOSITION CONTAINING THE SAME CHISSO CORPORATION (JP) 1996-11-13 EP disclosed
CN-1135515-A Liquid crystal alkynyl tolane compound, liquid crystal composition and liquid crystal display part CHISSO CORP (JP) 1996-11-13 CN disclosed
EP-0733692-A1 Liquid crystalline compound, liquid crystal composition containing the same, and display device Chisso Corporation (JP) 1996-09-25 EP disclosed
EP-0733610-A1 Liquid crystalline compound, liquid crystal composition containing the same and liquid crystal display device Chisso Corporation (JP) 1996-09-25 EP disclosed
EP-0727473-A2 Liquid crystaline alkynyltolan compound, liquid crystal composition and liquid crystal display element Chisso Corporation (JP) 1996-08-21 EP disclosed
EP-0679707-A1 Liquid crystalline compound, liquid crystal composition and liquid crystal display element Chisso Corporation (JP) 1995-11-02 EP disclosed
EP-0597701-A1 Conjugated enyne derivative and liquid crystal composition CHISSO CORPORATION (JP) 1994-05-18 EP disclosed