SCHEMBL9344768

SCHEMBL9344768

CCCCC[C@H]1CC[C@H](c2ccc(C#N)c(F)c2)CC1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.36
TRPV4 Q9HBA0 1/20 0.36
MAPT P10636 2/20 0.35
AR P10275 2/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
MAPK1 P28482 1/20 0.35
KDM1A O60341 5/20 0.35
GAA P10253 1/20 0.35
CHEK1 O14757 2/20 0.35
SPHK1 Q9NYA1 1/20 0.35
GRM2 Q14416 1/20 0.34
FASN P49327 1/20 0.34

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
SCHEMBL8077024 1.00 CYP2C9 (0.36) CYP2C9TRPV4MAPTARMEN1
SCHEMBL17190567 0.99 MAPT (0.37) CYP2C9TRPV4MAPTARMEN1
SCHEMBL5886452 0.99 MAPT (0.37) CYP2C9TRPV4MAPTARMEN1
SCHEMBL5886450 0.99 MAPT (0.37) CYP2C9TRPV4MAPTARMEN1
SCHEMBL8745378 0.96 CYP2C9 (0.34) CYP2C9TRPV4MAPTARMEN1
SCHEMBL9349786 0.96 CYP2C9 (0.37) CYP2C9TRPV4MAPTARMEN1
SCHEMBL9349783 0.96 CYP2C9 (0.37) CYP2C9TRPV4MAPTARMEN1
SCHEMBL10484059 0.95 MAPT (0.35) CYP2C9TRPV4MAPTARMEN1
SCHEMBL10484068 0.95 MAPT (0.35) CYP2C9TRPV4MAPTARMEN1
SCHEMBL10350024 0.95 MAPT (0.35) CYP2C9TRPV4MAPTARMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0393636-B1 Liquid crystal composition and liquid crystal display using said composition CHISSO CORP (JP) 1994-07-20 EP disclosed
US-5258135-A Multiplexed displays, supertwisted birefringence effect CHISSO CORPORATION (JP) 1993-11-02 US disclosed
EP-0318003-B1 A liquid crystal composition for twist nematic mode CHISSO CORP (JP) 1993-10-20 EP disclosed
EP-0432780-B1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY USING SAID COMPOSITION CHISSO CORPORATION (JP) 1993-07-21 EP disclosed
US-5102577-A Supertwisted birefringence system CHISSO CORPORATION (JP) 1992-04-07 US disclosed
EP-0325796-B1 A LIQUID CRYSTAL COMPOUND AND A MIXTURE CONTAINING THE SAME Chisso Corporation (JP) 1992-03-11 EP disclosed
EP-0432780-A1 Liquid crystal composition and liquid crystal display using said composition CHISSO CORPORATION (JP) 1991-06-19 EP disclosed
EP-0393636-A2 Liquid crystal composition and liquid crystal display using said composition CHISSO CORPORATION (JP) 1990-10-24 EP disclosed
US-4923632-A LOW THRESHOLD-VOLTAGE AND TEMPERATURE DEPENDENCY; CYCLOHEXYL-AND FLUORO-SUBSTITUTED BENZENE CHISSO CORPORATION (JP) 1990-05-08 US disclosed
US-4877548-A STABLE TO HEAT, LIGHT, ELECTRICITY AND MOISTURE CHISSO CORPORATION (JP) 1989-10-31 US disclosed
EP-0325796-A1 A liquid crystal compound and a mixture containing the same Chisso Corporation (JP) 1989-08-02 EP disclosed
EP-0318003-A2 A liquid crystal composition for twist nematic mode CHISSO CORPORATION (JP) 1989-05-31 EP disclosed
EP-0205503-A1 LIQUID CRYSTALLINE PHASE. MERCK PATENT GMBH (DE) 1986-12-30 EP disclosed
WO-1986003769-A1 LIQUID CRYSTALLINE PHASE MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1986-07-03 WO disclosed