SCHEMBL1269845

SCHEMBL1269845

CC1CCCC(C)CCC1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.44
TSHR P16473 1/20 0.44
CYP2C19 P33261 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
NOS3 P29474 3/20 0.33
NOS1 P29475 3/20 0.33
NOS2 P35228 3/20 0.33
ACHE P22303 2/20 0.33
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
CA4 P22748 2/20 0.33
EPHX1 P07099 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL1269342 1.00 CYP2C9 (0.44) CYP2C9TSHRCYP2C19TDP1NOS3
SCHEMBL34468141 1.00 CYP2C9 (0.44) CYP2C9TSHRCYP2C19TDP1NOS3
SCHEMBL6585508 0.95
SCHEMBL7075565 0.95 TDP1 (0.41) CYP2C9TSHRCYP2C19TDP1NOS3
SCHEMBL2368 0.95
SCHEMBL3001521 0.91 ACHE (0.42) CYP2C9TSHRCYP2C19TDP1ACHE
SCHEMBL1269311 0.91 EPHX1 (0.40) CYP2C9TSHRCYP2C19TDP1NOS3
Hydrochloric Acid SCHEMBL1937438 0.90
Ammonia Solution, Strong SCHEMBL3799540 0.90
Water SCHEMBL17309998 0.90 CYP2C9 (0.44) CYP2C9TSHRCYP2C19TDP1NOS3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12291684-B2 Method embodiments for partial hydrogenation of carbocyclic compounds to produce jet fuel blendstock BATTELLE MEMORIAL INSTITUTE (US) 2025-05-06 US claimed
US-20230193148-A1 METHOD EMBODIMENTS FOR PARTIAL HYDROGENATION OF CARBOCYCLIC COMPOUNDS TO PRODUCE JET FUEL BLENDSTOCK BATTELLE MEMORIAL INSTITUTE (US) 2023-06-22 US claimed
EP-2829555-B1 METHOD FOR PRODUCING OLEFIN POLYMER MITSUI CHEMICALS INC (JP) 2018-05-16 EP claimed
CN-104203993-B Process for producing olefin polymer 三井化学株式会社 2016-06-15 CN claimed
US-9315602-B2 Method for producing olefin polymer MITSUI CHEMICALS, INC. (JP) 2016-04-19 US claimed
US-20260117135-A1 SYSTEMS AND METHODS FOR PRODUCING A DIMETHYLCYCLOOCTANE-BASED AVIATION FUEL FROM ISOPRENE CleanJoule, Inc. (US) 2026-04-30 US disclosed
US-20260062631-A1 CYCLOOCTANE CONTAINING FUEL COMPOSITIONS THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2026-03-05 US disclosed
US-12503662-B1 Cyclooctane containing seal swelling compositions and methods for use of same CleanJoule, Inc. (US) 2025-12-23 US disclosed
US-12291684-B2 Method embodiments for partial hydrogenation of carbocyclic compounds to produce jet fuel blendstock BATTELLE MEMORIAL INSTITUTE (US) 2025-05-06 US disclosed
EP-4227299-A1 BENZIMIDAZOLONE GLP-1 RECEPTOR AGONIST AND USE THEREOF Hangzhou Zhongmeihuadong Pharmaceutical Co., Ltd. (CN) 2023-08-16 EP disclosed
CN-116528811-A Dry cleaning shampoo composition 弗门尼舍有限公司 2023-08-01 CN disclosed
CN-116391022-A Improved freshness imparting compositions 弗门尼舍有限公司 2023-07-04 CN disclosed
EP-1044972-A1 5,6,7-TRINOR-4,8-INTER-m-PHENYLENE PGI2 DERIVATIVE AND DRUGS CONTAINING THE SAME TORAY INDUSTRIES, INC. (JP) 2000-10-18 EP disclosed
US-6040449-A USEFUL FOR FORMING FLUORINE CONTAINING 1,4-DISUBSTITUTED PIPERIDINE DERIVATIVES, USEFUL AS ANTAGONIST FOR MUSCARINIC M3 RECEPTORS AND LESS SIDE EFFECT BANYU PHARMACEUTICAL CO LTD (JP) 2000-03-21 US disclosed
US-5948792-A POTENT AND SELECTIVE ANTAGONISTS FOR MUSCARINIC M.SUB.3 RECEPTORS WITH LITTLE SIDE EFFECTS. BANYU PHARMACEUTICAL CO., LTD. (JP) 1999-09-07 US disclosed
EP-0930298-A1 FLUORINATED 1,4-DISUBSTITUTED PIPERIDINE DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 1999-07-21 EP disclosed
EP-0916668-A1 CHEMOKINE RECEPTOR ANTAGONISTS BANYU PHARMACEUTICAL CO., LTD. (JP) 1999-05-19 EP disclosed
US-5750540-A SIDE EFFECT REDUCTION BANYU PHARMACEUTICAL CO., LTD. (JP) 1998-05-12 US disclosed
EP-0823423-A1 1,4-DISUBSTITUTED PIPERIDINE DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 1998-02-11 EP disclosed
US-4739120-A RHODIUM CATALYST, BASIC SOLUTION OR IMMISCIBLE ORGANIC SOLVENT AND WATER THE DOW CHEMICAL COMPANY (US) 1988-04-19 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-20260117135-A1 SYSTEMS AND METHODS FOR PRODUCING A DIMETHYLCYCLOOCTANE-BASED AVIATION FUEL FROM ISOPRENE ERG28, DIMT1, MSMO1 CYP2C9 1594/4885TSHR 3857/4885CYP2C19 2894/4885
US-12503662-B1 Cyclooctane containing seal swelling compositions and methods for use of same AQP1, GJA1, DSC1 CYP2C9 2835/4885TSHR 4878/4885CYP2C19 3722/4885
US-20260062631-A1 CYCLOOCTANE CONTAINING FUEL COMPOSITIONS CPT1A, CPT2, CNR2 CYP2C9 572/4885TSHR 3620/4885CYP2C19 1556/4885

“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.