SCHEMBL6734843

SCHEMBL6734843

CCCCC1CCC(C2CCC(=O)CC2)CC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 4/20 0.47
TLR4 O00206 3/20 0.42
LMNA P02545 1/20 0.40
MAPK1 P28482 1/20 0.40
HTT P42858 1/20 0.40
MAPT P10636 1/20 0.39
NAAA Q02083 1/20 0.38
POLB P06746 1/20 0.37
HPGD P15428 1/20 0.37
NOS1 P29475 2/20 0.35
NOS2 P35228 2/20 0.35
ADRB2 P07550 1/20 0.35
CHRM2 P08172 1/20 0.35
CHRM4 P08173 1/20 0.35
ADRB1 P08588 1/20 0.35
CHRM5 P08912 1/20 0.35
CHRM1 P11229 1/20 0.35
DRD2 P14416 1/20 0.35
CHRM3 P20309 1/20 0.35
DRD4 P21917 1/20 0.35

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
SCHEMBL6752745 1.00 CYP1A2 (0.47) CYP1A2TLR4LMNAMAPK1HTT
SCHEMBL7782150 1.00 CYP1A2 (0.47) CYP1A2TLR4LMNAMAPK1HTT
SCHEMBL2892324 0.94 CYP1A2 (0.46) CYP1A2TLR4LMNAMAPK1HTT
SCHEMBL1255189 0.94 CYP1A2 (0.46) CYP1A2TLR4LMNAMAPK1HTT
SCHEMBL6910065 0.94 CYP1A2 (0.46) CYP1A2TLR4LMNAMAPK1HTT
SCHEMBL13378068 0.94 CYP1A2 (0.46) CYP1A2TLR4LMNAMAPK1HTT
SCHEMBL10862180 0.93 CYP1A2 (0.45) CYP1A2TLR4HTTMAPTCHRM2
SCHEMBL19722190 0.93 CYP1A2 (0.45) CYP1A2TLR4HTTMAPTCHRM2
SCHEMBL10860316 0.93 CYP1A2 (0.45) CYP1A2TLR4HTTMAPTCHRM2
SCHEMBL10862187 0.93 CYP1A2 (0.45) CYP1A2TLR4HTTMAPTCHRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023214534-A1 AMINOPOLYESTER AND LIPID NANOPARTICLES 国立大学法人北海道大学 2023-11-09 WO disclosed
WO-2023214534-A1 AMINOPOLYESTER AND LIPID NANOPARTICLES 国立大学法人北海道大学 2023-11-09 WO disclosed
US-11366387-B2 Salt, acid generator, resist composition and method for producing resist pattern SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2022-06-21 US disclosed
US-20200057369-A1 SALT, ACID GENERATOR, RESIST COMPOSITION AND METHOD FOR PRODUCING RESIST PATTERN SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2020-02-20 US disclosed
US-6685995-B1 LOW VOLTAGE, WIDE TEMPERATURE RANGE DRIVING; HIGH SPEED RESPONSE CHISSO CORPORATION (JP) 2004-02-03 US disclosed
US-6682785-B2 A FLUOROANTHRACENE COMPOUNDS; HEAT RESISTANCE, RADIATION RESISTANCE, PHOTOSTABILITY CLARIANT FINANCE (BVI) LIMITED (VG) 2004-01-27 US disclosed
US-20030118749-A1 A fluoroanthracene compounds; heat resistance, radiation resistance, photostability CLARIANT INTERNATIONAL LTD. 2003-06-26 US disclosed
EP-0637623-B1 Cyclic hydrocarbon derivative and liquid crystal composition containing the same DAINIPPON INK & CHEMICALS (JP) 2001-10-04 EP disclosed
EP-1053996-A1 ESTER COMPOUNDS, LIQUID CRYSTAL COMPOSITIONS AND LIQUID CRYSTAL DISPLAY DEVICES CHISSO CORPORATION (JP) 2000-11-22 EP disclosed
US-5536443-A DUTERIUM CONTAINING COMPOUNDS FOOR ELECTROOPTICAL APPARATUS DAINIPPON INK & CHEMICALS, INC. (JP) 1996-07-16 US disclosed
US-5474707-A Electrooptic display DAINIPPON INK AND CHEMICALS, INC. (JP) 1995-12-12 US disclosed
EP-0637623-A1 Cyclic hydrocarbon derivative and liquid crystal composition containing the same DAINIPPON INK AND CHEMICALS, INC. (JP) 1995-02-08 EP disclosed
EP-0548897-A2 Cyclohexanone-oxime derivatives, method for their preparation as well as method for their further processing into cyclohexanone- and cyclohexylamine derivatives EMS-INVENTA AG (CH) 1993-06-30 EP disclosed
US-4617141-A LIQUID CRYSTALS CHISSO CORPORATION (JP) 1986-10-14 US disclosed
EP-0096850-B1 TRANS-4-ALKYLOXYMETHYL-1-(4'-SUBSTITUTED BIPHENYLYL-4)CYCLOHEXANES AND LIQUID CRYSTAL COMPOSITIONS CONTAINING THE SAME Chisso Corporation (JP) 1985-09-25 EP disclosed
US-4522741-A Trans-4-alkyloxymethyl-1-(4'-substituted biphenylyl-4)cyclohexanes CHISSO CORPORATION (JP) 1985-06-11 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

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

For each of this compound's patents that has machine-readable text (1 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-20030118749-A1 A fluoroanthracene compounds; heat resistance, radiation resistance, photostability HSF1, ABCC1, FLNA CYP1A2 80/4885TLR4 4679/4885LMNA 1382/4885

“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.