SCHEMBL136689

SCHEMBL136689

CCCCCC1CCCCCC1

nearest known ligand 0.85

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.85
SIGMAR1 Q99720 3/20 0.56
EPHX1 P07099 1/20 0.43
ALDH1A1 P00352 1/20 0.41
NAAA Q02083 1/20 0.40
TLR7 Q9NYK1 1/20 0.40
LSS P48449 1/20 0.40

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
SCHEMBL29076360 1.00 CYP1A2 (0.85) CYP1A2SIGMAR1EPHX1ALDH1A1NAAA
SCHEMBL133028 1.00 CYP1A2 (0.85) CYP1A2SIGMAR1EPHX1ALDH1A1NAAA
SCHEMBL7733446 1.00 CYP1A2 (0.85) CYP1A2SIGMAR1EPHX1ALDH1A1NAAA
SCHEMBL7733130 1.00 CYP1A2 (0.85) CYP1A2SIGMAR1EPHX1ALDH1A1NAAA
SCHEMBL133404 1.00 CYP1A2 (0.85) CYP1A2SIGMAR1EPHX1ALDH1A1NAAA
SCHEMBL25394046 1.00 CYP1A2 (0.85) CYP1A2SIGMAR1EPHX1ALDH1A1NAAA
SCHEMBL25391848 0.97 CYP1A2 (0.81) CYP1A2SIGMAR1EPHX1ALDH1A1NAAA
SCHEMBL25392743 0.97 CYP1A2 (0.81) CYP1A2SIGMAR1EPHX1ALDH1A1NAAA
SCHEMBL25391637 0.97 CYP1A2 (0.81) CYP1A2SIGMAR1EPHX1ALDH1A1NAAA
SCHEMBL25393174 0.97 CYP1A2 (0.81) CYP1A2SIGMAR1EPHX1ALDH1A1NAAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12441901-B2 Quantum dot ink composition, and quantum dot electroluminescent device SAMSUNG ELECTRONICS CO., LTD. (KR) 2025-10-14 US disclosed
US-20240182471-A1 METHODS AND COMPOSITIONS FOR SUBSTITUTED ARYLCYCLOHEPTANE ANALOGS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED 2024-06-06 US disclosed
CN-117897468-A Production of monoaromatics from hydrocarbon feedstocks 沙特基础工业全球技术有限公司 2024-04-16 CN disclosed
US-11912704-B2 Methods and compositions for substituted arylcycloheptane analogs UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2024-02-27 US disclosed
US-11912704-B2 Methods and compositions for substituted arylcycloheptane analogs UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2024-02-27 US disclosed
US-20230287231-A1 QUANTUM DOT INK COMPOSITION, AND QUANTUM DOT ELECTROLUMINESCENT DEVICE SAMSUNG ELECTRONICS CO., LTD. (KR) 2023-09-14 US disclosed
CN-116606568-A Quantum dot ink composition and quantum dot electroluminescent device 三星电子株式会社 2023-08-18 CN disclosed
US-20230257607-A1 QUANTUM DOT INK COMPOSITION, AND QUANTUM DOT ELECTROLUMINESCENT DEVICE SAMSUNG ELECTRONICS CO., LTD. (KR) 2023-08-17 US disclosed
US-20210300928-A1 METHODS AND COMPOSITIONS FOR SUBSTITUTED ARYLCYCLOHEPTANE ANALOGS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. 2021-09-30 US disclosed
WO-2020033567-A1 METHODS AND COMPOSITIONS FOR SUBSTITUTED ARYLCYCLOHEPTANE ANALOGS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION (US) 2020-02-13 WO disclosed
US-5755833-A URETHANE COMPOUND; ANTIDEPOSIT, ANTISLUDGING AGENT; GASOLINE NIPPON OIL CO., LTD. (JP) 1998-05-26 US disclosed
EP-0819753-A1 Fuel additive NIPPON OIL CO. LTD. (JP) 1998-01-21 EP disclosed
EP-0801128-A1 Fuel additive NIPPON OIL CO. LTD. (JP) 1997-10-15 EP disclosed
EP-0723985-A1 Fuel additive NIPPON OIL CO. LTD. (JP) 1996-07-31 EP disclosed
US-5155268-A Antiarrhythmic N-aminoalkylene alkyl and aryl sulfonamides THE UPJOHN COMPANY (US) 1992-10-13 US disclosed
EP-0164865-B1 N-(AMINOALKYLPHENYL)SULFONAMIDES THEIR PREPARATION AND THERAPEUTIC USE THE UPJOHN COMPANY (US) 1988-12-21 EP disclosed
EP-0164865-A1 N-(Aminoalkylphenyl)sulfonamides their preparation and therapeutic use THE UPJOHN COMPANY (US) 1985-12-18 EP disclosed
US-4352938-A ADHESION OF POLYPROPYLENE TO GLASS FIBERS OR TIRE CORDS TO RUBBER HERCULES INCORPORATED (US) 1982-10-05 US disclosed
US-4240971-A USED TO MODIFY AND CROSSLINK POLYMERS AND AS A BONDING AGENT HERCULES INCORPORATED (US) 1980-12-23 US disclosed
US-3992451-A IN THE PRESENCE OF FREE RADICAL CATALYSTS, HYDROGEN CHLORIDE, AND CARBON MONOXIDE UNIVERSAL OIL PRODUCTS COMPANY (US) 1976-11-16 US 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 (3 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-20210300928-A1 METHODS AND COMPOSITIONS FOR SUBSTITUTED ARYLCYCLOHEPTANE ANALOGS AHR, HCCS, HMBS CYP1A2 25/4885SIGMAR1 1822/4885EPHX1 485/4885
US-20240182471-A1 METHODS AND COMPOSITIONS FOR SUBSTITUTED ARYLCYCLOHEPTANE ANALOGS AHR, HCCS, HMBS CYP1A2 25/4885SIGMAR1 1822/4885EPHX1 485/4885
US-11912704-B2 Methods and compositions for substituted arylcycloheptane analogs AHR, HCCS, HMBS CYP1A2 25/4885SIGMAR1 1822/4885EPHX1 485/4885

“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.