SCHEMBL6561460

SCHEMBL6561460

CCCCCC1[CH]CCC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.38
CYP1A2 P05177 4/20 0.37
ALDH1A1 P00352 1/20 0.35
PSMB11 A5LHX3 1/20 0.33
PSMA7 O14818 1/20 0.33
PSMB1 P20618 1/20 0.33
PSMA1 P25786 1/20 0.33
PSMA2 P25787 1/20 0.33
PSMA3 P25788 1/20 0.33
PSMA4 P25789 1/20 0.33
PSMB8 P28062 1/20 0.33
PSMB9 P28065 1/20 0.33
PSMA5 P28066 1/20 0.33
PSMB4 P28070 1/20 0.33
PSMB6 P28072 1/20 0.33
PSMB5 P28074 1/20 0.33
PSMB10 P40306 1/20 0.33
PSMB3 P49720 1/20 0.33
PSMB2 P49721 1/20 0.33
PSMA6 P60900 1/20 0.33

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
SCHEMBL9214351 0.98 EPHX1 (0.41) EPHX1CYP1A2ALDH1A1PSMB11PSMA7
SCHEMBL4450962 0.98 EPHX1 (0.41) EPHX1CYP1A2ALDH1A1PSMB11PSMA7
SCHEMBL9474195 0.98 EPHX1 (0.41) EPHX1CYP1A2ALDH1A1PSMB11PSMA7
SCHEMBL27513432 0.98 EPHX1 (0.41) EPHX1CYP1A2ALDH1A1PSMB11PSMA7
SCHEMBL9591949 0.94 CYP1A2 (0.40) EPHX1CYP1A2ALDH1A1PSMB11PSMA7
SCHEMBL4942389 0.93
SCHEMBL5688099 0.92 EPHX1 (0.39) EPHX1CYP1A2ALDH1A1PSMB11PSMA7
SCHEMBL9950636 0.92 EPHX1 (0.39) EPHX1CYP1A2ALDH1A1PSMB11PSMA7
SCHEMBL9980541 0.92 EPHX1 (0.39) EPHX1CYP1A2ALDH1A1PSMB11PSMA7
SCHEMBL7201664 0.92 EPHX1 (0.39) EPHX1CYP1A2ALDH1A1PSMB11PSMA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1082287-B1 SLOW RELEASE OF FRAGRANT COMPOUNDS IN PERFUMERY USING 2-BENZOYL BENZOATES, 2-ALKANOYL BENZOATES OR ALPHA-KETO ESTERS FIRMENICH & CIE (CH) 2004-03-17 EP disclosed
US-6492323-B2 CONTROLLED RELEASE UPON EXPOSURE TO LIGHT FIRMENICH SA (CH) 2002-12-10 US disclosed
US-20010014661-A1 Slow release of fragrant compounds in perfumery using alpha-keto esters FIRMENICH SA (CH) 2001-08-16 US disclosed
US-6218355-B1 FOR RELEASING FRAGRANT COMPOUND OR COMPOUNDS IN A CONTROLLED MANNER, MAINTAINING A DESIRED SMELL OVER A PROLONGED PERIOD OF TIME FIRMENICH SA (CH) 2001-04-17 US disclosed
EP-1082287-A2 SLOW RELEASE OF FRAGRANT COMPOUNDS IN PERFUMERY USING 2-BENZOYL BENZOATES, 2-ALKANOYL BENZOATES OR ALPHA-KETO ESTERS FIRMENICH SA (CH) 2001-03-14 EP disclosed
WO-1999060990-A2 SLOW RELEASE OF FRAGRANT COMPOUNDS IN PERFUMERY USING 2-BENZOYL BENZOATES, 2-ALKANOYL BENZOATES OR α-KETO ESTERS FIRMENICH S.A. (CH) 1999-12-02 WO disclosed
EP-0339046-B1 LEUKOTRIENE B 4 ANALOGS UPJOHN CO (US) 1995-02-15 EP disclosed
US-5116981-A Antiinflammatory leukotriene B4 analogs THE UPJOHN COMPANY (US) 1992-05-26 US disclosed
EP-0234485-B1 SUBSTITUTED THIENOIMIDAZOLE DERIVATIVES, PROCESSES FOR THEIR PRODUCTION, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USE AS GASTRIC SECRETION INHIBITORS HOECHST AKTIENGESELLSCHAFT (DE) 1992-04-01 EP disclosed
US-5053526-A Platelet aggregation, hypotensive agents, vasodilators and antiulcer agents MITSUBISHI KASEI CORPORATION (JP) 1991-10-01 US disclosed
US-3969381-A 13,14-Dihydro-16-fluoro prostaglandin B1 analogs THE UPJOHN COMPANY (US) 1976-07-13 US disclosed
US-3969379-A 13,14-Dihydro-16-fluoro prostaglandin A1 analogs THE UPJOHN COMPANY (US) 1976-07-13 US disclosed
US-3969380-A 16-Fluoro prostaglandin F2 analogs THE UPJOHN COMPANY (US) 1976-07-13 US disclosed
US-3969376-A 13,14-Dihydro-16-fluoro prostaglandin E1 analogs THE UPJOHN COMPANY (US) 1976-07-13 US disclosed
US-3969377-A 16-Fluoro prostaglandin E1 analogs THE UPJOHN COMPANY (US) 1976-07-13 US disclosed
US-3965118-A Lactone intermediates THE UPJOHN COMPANY (US) 1976-06-22 US disclosed
US-3962293-A 13,14-Dihydro-16-fluoro prostaglandin F1 THE UPJOHN COMPANY (US) 1976-06-08 US disclosed
US-3954835-A 4,5-Cis-didehydro-PGF1 compounds THE UPJOHN COMPANY (US) 1976-05-04 US disclosed
US-3933889-A 4,5-Cis-didehydro-PGF1.sub.α analogs THE UPJOHN COMPANY (US) 1976-01-20 US disclosed
US-3931279-A 5-Oxa prostaglandin F2.sub.α analogs THE UPJOHN COMPANY (US) 1976-01-06 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-20010014661-A1 Slow release of fragrant compounds in perfumery using alpha-keto esters FAAH, KHK, FAAH2 EPHX1 203/4885CYP1A2 258/4885ALDH1A1 122/4885

“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.