SCHEMBL7908258

SCHEMBL7908258

CCCC[C@H]1CC[C@H](c2ccc(C(=O)Oc3ccc(C#N)c(F)c3)cc2)CC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.42
ALDH1A1 P00352 3/20 0.41
MAPT P10636 3/20 0.41
LMNA P02545 1/20 0.41
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
MAPK1 P28482 1/20 0.36
PRSS1 P07477 2/20 0.36
ACR P10323 2/20 0.36
HPGD P15428 1/20 0.35
RAB9A P51151 1/20 0.34
TRPV4 Q9HBA0 1/20 0.34
TRPC3 Q13507 1/20 0.34
TRPC6 Q9Y210 1/20 0.34
GPR119 Q8TDV5 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
AOC3 Q16853 2/20 0.34
TRPA1 O75762 1/20 0.33
FASN P49327 1/20 0.33
KDM1A O60341 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
SCHEMBL7507632 1.00 CYP2C9 (0.42) CYP2C9ALDH1A1MAPTLMNAKMT2A
SCHEMBL13325809 0.97 CYP2C9 (0.42) CYP2C9ALDH1A1MAPTLMNAKMT2A
SCHEMBL7514450 0.97 CYP2C9 (0.42) CYP2C9ALDH1A1MAPTLMNAKMT2A
SCHEMBL7907223 0.97 CYP2C9 (0.42) CYP2C9ALDH1A1MAPTLMNAKMT2A
SCHEMBL14300471 0.94 CYP2C9 (0.42) CYP2C9ALDH1A1MAPTLMNAKMT2A
SCHEMBL5886341 0.94 CYP2C9 (0.49) CYP2C9ALDH1A1MAPTLMNAKMT2A
SCHEMBL7910632 0.94 CYP2C9 (0.49) CYP2C9ALDH1A1MAPTLMNAKMT2A
SCHEMBL20152471 0.94 CYP2C9 (0.49) CYP2C9ALDH1A1MAPTLMNAKMT2A
SCHEMBL10779966 0.91 CYP2C9 (0.37) CYP2C9ALDH1A1MAPTLMNAKMT2A
SCHEMBL14300468 0.91 CYP2C9 (0.42) 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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6210760-B1 SHORT SWITCHING TIMES AND GRADIENTS AND ANGULAR DEPENDENCIES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2001-04-03 US disclosed
EP-0679707-B1 Liquid crystalline compound, liquid crystal composition and liquid crystal display element CHISSO CORP (JP) 1999-06-16 EP disclosed
US-5876626-A HIGH SPEED SWITCHING MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1999-03-02 US disclosed
EP-0733610-B1 Liquid crystalline compound, liquid crystal composition containing the same and liquid crystal display device CHISSO CORP (JP) 1998-10-28 EP disclosed
US-5720899-A Liquid crystalline compound, liquid crystal composition and liquid crystal display element CHISSO CORPORATION (JP) 1998-02-24 US disclosed
US-5653911-A Liquid crystalline compound liquid crystal composition and liquid crystal display element CHISSO CORPORATION (JP) 1997-08-05 US 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
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-0679707-A1 Liquid crystalline compound, liquid crystal composition and liquid crystal display element Chisso Corporation (JP) 1995-11-02 EP disclosed
US-5387369-A With specified mixture of components; short switching times MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1995-02-07 US disclosed
US-5030383-A With low temperature dependence of threshold voltage MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1991-07-09 US disclosed
US-4877547-A Liquid crystal display element MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1989-10-31 US disclosed