SCHEMBL8095323

SCHEMBL8095323

CCCC1CCC(c2ccc(-c3ccc(C(F)(F)F)cc3)cc2)CC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.54
LMNA P02545 1/20 0.54
MAPT P10636 1/20 0.54
CYP2C9 P11712 1/20 0.52
HTR2C P28335 2/20 0.50
MEN1 O00255 1/20 0.50
MAPK1 P28482 1/20 0.50
KMT2A Q03164 1/20 0.50
DGAT1 O75907 1/20 0.43
SOAT1 P35610 1/20 0.43
P2RY14 Q15391 4/20 0.42
ESR2 Q92731 1/20 0.41
KDM1A O60341 1/20 0.40
RCOR1 Q9UKL0 1/20 0.40
ADRB3 P13945 1/20 0.39
ADRA2B P18089 1/20 0.39
DRD1 P21728 1/20 0.39
DRD5 P21918 1/20 0.39
ADRA1B P35368 1/20 0.39
TMEM97 Q5BJF2 1/20 0.39

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
SCHEMBL8095319 1.00 ALDH1A1 (0.54) ALDH1A1LMNAMAPTCYP2C9HTR2C
SCHEMBL8997288 0.95 ALDH1A1 (0.57) ALDH1A1LMNAMAPTCYP2C9HTR2C
SCHEMBL9347904 0.94 ALDH1A1 (0.56) ALDH1A1LMNAMAPTCYP2C9HTR2C
SCHEMBL12032020 0.93 ALDH1A1 (0.47) ALDH1A1LMNAMAPTCYP2C9HTR2C
SCHEMBL11286081 0.91 HTR2C (0.47) ALDH1A1LMNAMAPTCYP2C9HTR2C
SCHEMBL9224351 0.91 ALDH1A1 (0.54) ALDH1A1LMNAMAPTCYP2C9HTR2C
SCHEMBL9224357 0.91 ALDH1A1 (0.54) ALDH1A1LMNAMAPTCYP2C9HTR2C
SCHEMBL9224377 0.91 ALDH1A1 (0.54) ALDH1A1LMNAMAPTCYP2C9HTR2C
SCHEMBL10453440 0.90 HTR2C (0.46) ALDH1A1LMNAMAPTCYP2C9HTR2C
SCHEMBL11285346 0.90 HTR2C (0.46) ALDH1A1LMNAMAPTCYP2C9HTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100237286-A1 LIQUID CRYSTAL MIXTURE DAILY POLYMER CORP. (TW) 2010-09-23 US disclosed
US-20100171074-A1 LIQUID CRYSTAL MIXTURE DAILY POLYMER CORP. (TW) 2010-07-08 US disclosed
EP-0628532-B1 Fluorobenzole derivatives and mesomorphous medium MERCK PATENT GMBH (DE) 2000-01-19 EP disclosed
US-5641429-A STABLE COMPOUNDS HAVING LOW VISCOSITY AND HIGH DIELECTRIC ANISOTROPY MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1997-06-24 US disclosed
US-5536442-A ELECTROOPTICS MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1996-07-16 US disclosed
US-5487845-A ELECTROOPTICAL DISPLAY ELEMENTS; CHEMICAL, HEAT AND LIGHT STABILITY MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1996-01-30 US disclosed
EP-0462243-B1 MATRIX LIQUID CRYSTAL DISPLAY MERCK PATENT GMBH (DE) 1995-09-13 EP disclosed
EP-0441932-B1 FLUOROBENZOLE DERIVATIVES AND MESOMORPHOUS MEDIUM MERCK PATENT GMBH (DE) 1995-03-15 EP disclosed
EP-0628532-A1 Fluorobenzole derivatives and mesomorphous medium MERCK PATENT GmbH (DE) 1994-12-14 EP disclosed
EP-0462243-A1 MATRIX LIQUID CRYSTAL DISPLAY. MERCK PATENT GMBH (DE) 1991-12-27 EP disclosed
WO-1991010716-A1 MATRIX LIQUID CRYSTAL DISPLAY MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1991-07-25 WO disclosed
WO-1991003450-A1 FLUOROBENZOLE DERIVATIVES AND MESOMORPHOUS MEDIUM MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1991-03-21 WO disclosed
EP-0022183-B1 DERIVATIVES OF CYCLOHEXYLBIPHENYL, PROCESS FOR THEIR PREPARATION, DIELECTRICS CONTAINING THEM, AND ELECTRON OPTICAL INDICATING ELEMENTS MERCK PATENT GmbH (DE) 1982-06-23 EP disclosed
US-4330426-A Cyclohexylbiphenyls, their preparation and use in dielectrics and electrooptical display elements MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1982-05-18 US disclosed
EP-0022183-A2 Derivatives of cyclohexylbiphenyl, process for their preparation, dielectrics containing them, and electron optical indicating elements MERCK PATENT GmbH (DE) 1981-01-14 EP disclosed