SCHEMBL3437359

SCHEMBL3437359

CCCC1CCC(C2CCC(c3ccc(OC(F)(F)F)c(F)c3)CC2)CC1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.41
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40
MEN1 O00255 1/20 0.40
MAPK1 P28482 1/20 0.40
KMT2A Q03164 1/20 0.40
EPHX2 P34913 7/20 0.36
PDE2A O00408 5/20 0.36
KDM1A O60341 2/20 0.36
HCRTR1 O43613 1/20 0.33
HCRTR2 O43614 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
SCHEMBL8110570 1.00 CYP2C9 (0.41) CYP2C9ALDH1A1LMNAMAPTMEN1
SCHEMBL8771358 1.00 CYP2C9 (0.41) CYP2C9ALDH1A1LMNAMAPTMEN1
SCHEMBL12032016 0.95 CYP2C9 (0.38) CYP2C9ALDH1A1LMNAMAPTMEN1
SCHEMBL12032235 0.95 CYP2C9 (0.38) CYP2C9ALDH1A1LMNAMAPTMEN1
SCHEMBL6460328 0.93 KDM1A (0.36) CYP2C9ALDH1A1LMNAMAPTMEN1
SCHEMBL6460322 0.93 KDM1A (0.36) CYP2C9ALDH1A1LMNAMAPTMEN1
SCHEMBL23666202 0.93 EPHX2 (0.35) CYP2C9ALDH1A1LMNAMAPTMEN1
SCHEMBL8771385 0.92 EPHX2 (0.35) CYP2C9ALDH1A1LMNAMAPTMEN1
SCHEMBL8771393 0.92 EPHX2 (0.35) CYP2C9ALDH1A1LMNAMAPTMEN1
SCHEMBL8771398 0.92 EPHX2 (0.35) CYP2C9ALDH1A1LMNAMAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210222067-A1 LIQUID-CRYSTAL MEDIUM MERCK PATENT GMBH (DE) 2021-07-22 US disclosed
EP-3129829-B1 LIQUID CRYSTAL MATERIAL MERCK PATENT GMBH (DE) 2019-10-30 EP disclosed
US-20190144750-A1 POLYMERIZABLE COMPOUND AND LIQUID CRYSTAL COMPOSITION CONTAINING THE SAME DIC CORPORATION (JP) 2019-05-16 US disclosed
US-10287502-B2 Liquid crystal composition containing polymerizable compound and liquid crystal display element using the same DIC Corporation (Tokyo) (JP) 2019-05-14 US disclosed
US-10260001-B2 Liquid crystal material MERCK PATENT GMBH (DE) 2019-04-16 US disclosed
US-10011771-B2 Liquid crystal composition containing polymerizable compound and liquid crystal display element using same DIC Corporation (Tokyo) (JP) 2018-07-03 US disclosed
US-10011771-B2 Liquid crystal composition containing polymerizable compound and liquid crystal display element using same DIC Corporation (Tokyo) (JP) 2018-07-03 US disclosed
US-9725651-B2 Polymerizable compound-containing liquid crystal composition and liquid crystal display element using same DIC CORPORATION (JP) 2017-08-08 US disclosed
US-9725651-B2 Polymerizable compound-containing liquid crystal composition and liquid crystal display element using same DIC CORPORATION (JP) 2017-08-08 US disclosed
US-9598639-B2 Liquid-crystal compound, liquid-crystal composition and liquid-crystal display device DAXIN MATERIALS CORPORATION (TW) 2017-03-21 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
EP-0799878-A1 Liquid crystal compositions and liquid crystal display elements containing same Shin-Etsu Chemical Co., Ltd. (JP) 1997-10-08 EP disclosed
EP-0471831-B1 LIQUID CRYSTALLINE MEDIUM MERCK PATENT GMBH (DE) 1996-08-14 EP disclosed
EP-0502407-B1 Nematic liquid-crystal composition for active matrix application SHARP KK (JP) 1996-02-07 EP disclosed
EP-0502406-B1 Nematic liquid-crystal composition for active matrix application SHARP KK (JP) 1995-11-15 EP disclosed
US-5389289-A Chemical and heat resistance MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1995-02-14 US disclosed
US-5330679-A Low temperature stability MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1994-07-19 US disclosed
US-5308543-A Fluorinated carbocyclic compounds; high voltage holding ratio; low temperature stability MERCK PATENT GESELLSCHAFT MIT BESRANKTER HAFTUNG (DE) 1994-05-03 US disclosed
EP-0502406-A1 Nematic liquid-crystal composition for active matrix application SHARP CORPORATION (JP) 1992-09-09 EP disclosed
EP-0502407-A1 Nematic liquid-crystal composition for active matrix application SHARP CORPORATION (JP) 1992-09-09 EP disclosed