SCHEMBL1666552

SCHEMBL1666552

CCCC1CCC(C2CCC(=O)CC2)CC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR4 O00206 2/20 0.51
CYP2C9 P11712 1/20 0.37
ALDH1A1 P00352 2/20 0.35
MAPT P10636 2/20 0.35
LMNA P02545 1/20 0.35
KMT2A Q03164 2/20 0.34
OPRM1 P35372 3/20 0.34
OPRL1 P41146 3/20 0.34
NOS3 P29474 4/20 0.32
NOS1 P29475 4/20 0.32
NOS2 P35228 4/20 0.32
OPRK1 P41145 1/20 0.32
MEN1 O00255 1/20 0.32
MAPK1 P28482 1/20 0.32
CHRM2 P08172 1/20 0.31
CHRM4 P08173 1/20 0.31
CHRM5 P08912 1/20 0.31
CHRM1 P11229 1/20 0.31
DRD2 P14416 1/20 0.31
CHRM3 P20309 1/20 0.31

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
SCHEMBL8215701 1.00 TLR4 (0.51) TLR4CYP2C9ALDH1A1MAPTLMNA
SCHEMBL1666553 1.00 TLR4 (0.51) TLR4CYP2C9ALDH1A1MAPTLMNA
SCHEMBL9979138 0.90 TLR4 (0.51) TLR4CYP2C9OPRM1OPRL1NOS3
SCHEMBL7912298 0.90 TLR4 (0.44) TLR4CYP2C9ALDH1A1MAPTLMNA
SCHEMBL7912304 0.90 TLR4 (0.44) TLR4CYP2C9ALDH1A1MAPTLMNA
SCHEMBL7912286 0.90 TLR4 (0.44) TLR4CYP2C9ALDH1A1MAPTLMNA
SCHEMBL6454016 0.89 TLR4 (0.50) TLR4CYP2C9OPRM1OPRL1
SCHEMBL6451893 0.89 TLR4 (0.50) TLR4CYP2C9OPRM1OPRL1
SCHEMBL6451888 0.89 TLR4 (0.50) TLR4CYP2C9OPRM1OPRL1
SCHEMBL6752745 0.88 CYP1A2 (0.47) TLR4MAPTLMNANOS1NOS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117550951-A Preparation method of 1- [4- (4- (4-propylcyclohexyl)) -1-alkene-cyclohexyl ] -4-trifluoromethyl benzene 江苏广域化学有限公司 2024-02-13 CN claimed
US-12618008-B2 Liquid crystal medium MERCK PATENT GMBH (DE) 2026-05-05 US disclosed
US-12595417-B2 Liquid-crystal medium MERCK PATENT GMBH (DE) 2026-04-07 US disclosed
US-20250361444-A1 Liquid Crystal Medium MERCK PATENT GMBH (DE) 2025-11-27 US disclosed
EP-4653511-A1 LIQUID CRYSTAL MEDIUM Merck Patent GmbH (DE) 2025-11-26 EP disclosed
US-20250215323-A1 LIQUID-CRYSTAL MEDIUM MERCK PATENT GMBH (DE) 2025-07-03 US disclosed
EP-4578929-A1 LIQUID-CRYSTAL MEDIUM Merck Patent GmbH (DE) 2025-07-02 EP disclosed
CN-119120038-A Liquid crystal medium, liquid crystal display device containing same and compound 默克专利股份有限公司 2024-12-13 CN disclosed
CN-114144498-B Liquid crystal medium, liquid crystal display device containing same and compound 默克专利股份有限公司 2024-09-10 CN disclosed
EP-3994234-B1 LIQUID-CRYSTALLINE MEDIUM AND LIQUID-CRYSTAL DISPLAY COMPRISING THE SAME AND COMPOUNDS MERCK PATENT GMBH (DE) 2024-02-21 EP disclosed
US-4477369-A New high temperature liquid-crystalline substances consisting of 4 or 5 six-member-rings and liquid-crystalline compositions containing same CHISSO CORPORATION (JP) 1984-10-16 US disclosed
EP-0062470-B1 LIQUID CRYSTAL BENZENE DERIVATIVES Chisso Corporation (JP) 1984-08-15 EP disclosed
US-4439340-A LIQUID CRYSTALS CHISSO CORPORATION (JP) 1984-03-27 US disclosed
EP-0096850-A1 Trans-4-alkyloxymethyl-1-(4'-substituted biphenylyl-4)cyclohexanes and liquid crystal compositions containing the same Chisso Corporation (JP) 1983-12-28 EP disclosed
US-4422951-A Liquid crystal benzene derivatives CHISSO CORPORATION (JP) 1983-12-27 US disclosed
EP-0094487-A1 Hydroterphenyls, their preparation and their use in dielectric liquid crystal material MERCK PATENT GmbH (DE) 1983-11-23 EP disclosed
EP-0090671-A1 Carbocylic esters having liquid-crystal properties at high temperatures Chisso Corporation (JP) 1983-10-05 EP disclosed
US-4405488-A LOW VISCOSITY, HIGH TRANSPARENT POINT CHISSO CORPORATION (JP) 1983-09-20 US disclosed
EP-0084974-A1 Carbocyclic compounds with liquid-crystal properties Chisso Corporation (JP) 1983-08-03 EP disclosed
EP-0062470-A1 Liquid crystal benzene derivatives Chisso Corporation (JP) 1982-10-13 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-12595417-B2 Liquid-crystal medium MEF2D, HCN2, HCN3 TLR4 3498/4885CYP2C9 3080/4885ALDH1A1 1628/4885
US-20250361444-A1 Liquid Crystal Medium FES, SOST, VIM TLR4 1413/4885CYP2C9 4579/4885ALDH1A1 4846/4885
US-12618008-B2 Liquid crystal medium VIM, FES, NES TLR4 1626/4885CYP2C9 4497/4885ALDH1A1 4461/4885
US-20250215323-A1 LIQUID-CRYSTAL MEDIUM NEFM, FES, FLNB TLR4 4406/4885CYP2C9 4071/4885ALDH1A1 3464/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.