SCHEMBL1906708

SCHEMBL1906708

OCC1CCCCCCCCCC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 5/20 0.40
▸ ESR2 Q92731 5/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ CYP2D6 P10635 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ CHRM5 P08912 2/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ ADRA2C P18825 1/20 0.39
▸ CHRM2 P08172 1/20 0.39
▸ CHRM4 P08173 1/20 0.39
▸ CHRM1 P11229 1/20 0.39
▸ EPHX1 P07099 2/20 0.37
▸ HPGD P15428 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ ALOX5 P09917 1/20 0.37
▸ APLNR P35414 1/20 0.36
▸ SIGMAR1 Q99720 1/20 0.36
▸ ADH1B P00325 1/20 0.36
▸ ADH1C P00326 1/20 0.36
▸ ADH1A P07327 1/20 0.36

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
SCHEMBL13646378 1.00 ESR1 (0.40) ESR1ESR2CYP3A4CYP2D6CYP2C9
SCHEMBL330190 1.00 — —
SCHEMBL14306984 1.00 ESR1 (0.40) ESR1ESR2CYP3A4CYP2D6CYP2C9
Cyclohexane SCHEMBL7799464 1.00 ESR1 (0.40) ESR1ESR2CYP3A4CYP2D6CYP2C9
SCHEMBL13825653 1.00 ESR1 (0.40) ESR1ESR2CYP3A4CYP2D6CYP2C9
SCHEMBL20903 1.00 — —
Cyclopentane SCHEMBL9063672 1.00 ESR1 (0.40) ESR1ESR2CYP3A4CYP2D6CYP2C9
SCHEMBL16260127 1.00 ESR1 (0.40) ESR1ESR2CYP3A4CYP2D6CYP2C9
SCHEMBL4986081 1.00 ESR1 (0.40) ESR1ESR2CYP3A4CYP2D6CYP2C9
SCHEMBL13973760 1.00 ESR1 (0.40) ESR1ESR2CYP3A4CYP2D6CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2391597-B1 METHOD FOR PRODUCING PURE CYCLODODECANONE BASF SE (DE) 2018-08-22 — — EP disclosed
EP-2041061-B1 Purification of cyclododecanon via thermic treatment BASF SE (DE) 2013-05-08 — — EP disclosed
US-8188320-B2 Process for preparing pure cyclododecanone BASF SE (DE) 2012-05-29 — — US disclosed
EP-2038245-B1 METHOD FOR PURIFYING CYCLIC KETONES BASF SE (DE) 2011-05-25 — — EP disclosed
WO-2010115869-A1 PROPOFOL PHOSPHONYL DERIVATIVES, SYNTHESIS, AND USE IN LONG ACTING FORMULATIONS SEPS PHARMA N.V. (BE) 2010-10-14 — — WO disclosed
US-7790930-B2 Method for purifying cyclic ketones BASF SE (DE) 2010-09-07 — — US disclosed
US-20100191018-A1 PROCESS FOR PREPARING PURE CYCLODODECANONE BASF SE (DE) 2010-07-29 — — US disclosed
US-7714171-B2 Method for purifying cyclic ketones BASF SE (DE) 2010-05-11 — — US disclosed
US-20090326277-A1 METHOD FOR PURIFYING CYCLIC KETONES BASF SE (DE) 2009-12-31 — — US disclosed
US-20090318733-A1 METHOD FOR PURIFYING CYCLIC KETONES BASF SE (DE) 2009-12-24 — — US disclosed
US-5635302-A CURED COATING COMPRISING STERICALLY HINDERED MONOMER AND ETHYLENICALLY UNSATURATED COMONOMER BASF CORPORATION (US) 1997-06-03 — — US disclosed
EP-0073042-B1 POLYESTER COMPOSITION ETHYL CORPORATION (US) 1987-10-07 — — EP disclosed
US-4539352-A POLYETHYLENE TEREPHTHALATE WITH EPOXIDIZED PLASTICIZER AND NUCLEATION AGENT ETHYL CORPORATION (US) 1985-09-03 — — US disclosed
EP-0046961-B1 EPOXY-CYCLOALKYLALKANECARBOXYLIC ACIDS, PROCESS FOR THEIR PREPARATION, THEIR USE AND MEDICAMENTS CONTAINING THEM Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 1985-02-13 — — EP disclosed
US-4486561-A EPOXIDIZED ESTER AND NUCLEATING AGENT ETHYL CORPORATION (US) 1984-12-04 — — US disclosed
US-4430339-A PROPHYLAXIS, METABOLISM, GLUCOSE, FATS, HYPOGLYCEMIC AGENTS BYK GULDEN LOMBERG CHEMISCHE FABRIK GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1984-02-07 — — US disclosed
EP-0073042-A1 Polyester composition ETHYL CORPORATION (US) 1983-03-02 — — EP disclosed
EP-0046961-A1 Epoxy-cycloalkylalkanecarboxylic acids, process for their preparation, their use and medicaments containing them Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 1982-03-10 — — EP disclosed
US-4017505-A FUNGICIDES, ANTHELMINTICS MERCK & CO., INC. (US) 1977-04-12 — — US disclosed
US-3936479-A 2-BENZAMIDO-BENZOPHENONES, UV STABILIZERS, PLASTICS SANDOZ LTD., (SANDOZ AG) (CH) 1976-02-03 — — 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 (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-20100191018-A1 PROCESS FOR PREPARING PURE CYCLODODECANONE CCNA1, CYC1, CCNA2 ESR1 2905/4885ESR2 1405/4885CYP3A4 363/4885

“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.

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