SCHEMBL43078

SCHEMBL43078

CC1(c2ccccc2)CCCC1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.46
AKR1C1 Q04828 1/20 0.46
OPRM1 P35372 1/20 0.46
OPRK1 P41145 1/20 0.46
OPRL1 P41146 1/20 0.46
SLC6A4 P31645 2/20 0.45
SLC6A2 P23975 1/20 0.45
SLC6A3 Q01959 1/20 0.45
SLC18A3 Q16572 1/20 0.45

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
SCHEMBL2387990 0.97 SLC6A4 (0.48) DPP4OPRM1SLC6A4SLC6A2SLC6A3
Hydrogen Peroxide SCHEMBL9938277 0.97 AKR1C1 (0.50) DPP4AKR1C1OPRM1OPRK1OPRL1
SCHEMBL19382448 0.97 SLC6A4 (0.48) DPP4OPRM1SLC6A4SLC6A2SLC6A3
Ammonia Solution, Strong SCHEMBL20553594 0.97 DPP4 (0.45) DPP4AKR1C1OPRM1OPRK1OPRL1
SCHEMBL353050 0.95 OPRL1 (0.46) DPP4AKR1C1OPRM1OPRK1OPRL1
SCHEMBL498014 0.89 OPRM1 (0.50) OPRM1OPRK1OPRL1
Ammonia Solution, Strong SCHEMBL9556021 0.86 OPRM1 (0.48) OPRM1OPRK1OPRL1
SCHEMBL10990510 0.85 AKR1C1 (0.41) AKR1C1SLC6A4SLC6A2SLC6A3
SCHEMBL10602015 0.83 ESR1 (0.42) SLC6A4SLC6A2SLC6A3
SCHEMBL14704743 0.81 OPRM1 (0.53) OPRM1SLC6A4SLC18A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120059684-A Raw material composition for organic synthesis reaction, application thereof, hydrogenated terphenyl synthetic heat conduction oil and preparation method thereof 中国石油化工股份有限公司 2025-05-30 CN claimed
CN-120059683-A Synthetic heat conduction oil and application 中国石油化工股份有限公司 2025-05-30 CN claimed
US-10710945-B2 Aromatic compositions and methods for obtaining them EXXONMOBIL CHEMICAL PATENTS INC. (US) 2020-07-14 US claimed
CN-105829273-B Process for preparing phenol and/or cyclohexanone 埃克森美孚化学专利公司 2019-05-28 CN claimed
US-10259759-B2 Cyclohexylbenzene composition EXXONMOBIL CHEMICAL PATENTS INC. (US) 2019-04-16 US claimed
US-20180237361-A1 Aromatic Compositions and Methods for Obtaining Them EXXONMOBIL CHEMICAL PATENTS INC. 2018-08-23 US claimed
US-9908829-B2 Process for making phenol and/or cyclohexanone EXXONMOBIL CHEMICAL PATENTS INC. (US) 2018-03-06 US claimed
WO-2017052790-A1 AROMATIC COMPOSITIONS AND METHODS FOR OBTAINING THEM EXXONMOBIL CHEMICAL PATENTS INC. (US) 2017-03-30 WO claimed
US-20170057895-A1 Phenol Composition EXXONMOBIL CHEMICAL PATENTS INC. 2017-03-02 US claimed
US-20170001930-A1 Cyclohexylbenzene Composition EXXONMOBIL CHEMICAL PATENTS INC. 2017-01-05 US claimed
WO-2010098916-A2 PROCESS FOR PRODUCING PHENOL EXXONMOBIL CHEMICAL PATENTS INC. (US) 2010-09-02 WO claimed
WO-2009128984-A1 PROCESS FOR PRODUCING CYCLOHEXYLBENZENE EXXONMOBIL CHEMICAL PATENTS INC. (US) 2009-10-22 WO claimed
EP-1663962-A4 COMPOSITIONS AND METHODS FOR THE TREATMENT OF DISEASE ASSOCIATED WITH TRP-P8 EXPRESSION DENDREON CORP (US) 2007-08-22 EP claimed
JP-2007503392-A 2007-02-22 JP claimed
EP-1663962-A2 COMPOSITIONS AND METHODS FOR THE TREATMENT OF DISEASE ASSOCIATED WITH TRP-P8 EXPRESSION DENDREON CORPORATION (US) 2006-06-07 EP claimed
US-20050054651-A1 Compositions and methods for the treatment of disease associated with Trp-p8 expression DENDREON CORPORATION (US) 2005-03-10 US claimed
WO-2005020897-A2 COMPOSITIONS AND METHODS FOR THE TREATMENT OF DISEASE ASSOCIATED WITH TRP-P8 EXPRESSION DENDREON CORPORATION (US) 2005-03-10 WO claimed
EP-1053224-B1 BIPHENYLSULFONYL CYANAMIDES, METHOD FOR THE PRODUCTION THEREOF AND THEIR UTILIZATION AS A MEDICAMENT AVENTIS PHARMA GMBH (DE) 2002-08-21 EP claimed
US-6369069-B1 CARDIOVASCULAR DISORDERS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2002-04-09 US claimed
US-3959226-A ISOMERIZATION; FRIEDEL-CRAFTS CATALYST UNIVERSAL OIL PRODUCTS COMPANY (US) 1976-05-25 US claimed

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

For each of this compound's patents that has machine-readable text (6 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-20180237361-A1 Aromatic Compositions and Methods for Obtaining Them AHR, ARNT, TDO2 DPP4 3133/4885AKR1C1 1001/4885OPRM1 4139/4885
US-10259759-B2 Cyclohexylbenzene composition CYP1B1, CYP4B1, MCCC2 DPP4 3908/4885AKR1C1 525/4885OPRM1 1831/4885
US-20170001930-A1 Cyclohexylbenzene Composition CYP1B1, CYP4B1, MCCC2 DPP4 3908/4885AKR1C1 525/4885OPRM1 1831/4885
US-20170057895-A1 Phenol Composition CYP4B1, CYP26B1, CYP1B1 DPP4 3314/4885AKR1C1 708/4885OPRM1 1825/4885
US-10710945-B2 Aromatic compositions and methods for obtaining them AHR, ARNT, TDO2 DPP4 3133/4885AKR1C1 1001/4885OPRM1 4139/4885
US-20050054651-A1 Compositions and methods for the treatment of disease associated with Trp-p8 expression TRPC4, TRPC3, TRPC1 DPP4 2440/4885AKR1C1 3419/4885OPRM1 578/4885

“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.