SCHEMBL305123

SCHEMBL305123

CCCCCCCCCCCCCCCCCCCNC=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 6/20 1.00
ADH1B P00325 4/20 1.00
ADH1A P07327 4/20 1.00
ADH7 P40394 4/20 1.00
ADH1C P00326 3/20 1.00
ADH4 P08319 2/20 1.00
TSHR P16473 3/20 0.55
ALDH1A1 P00352 1/20 0.55
FAAH O00519 2/20 0.48
TRPV1 Q8NER1 1/20 0.48
S1PR2 O95136 2/20 0.45
S1PR4 O95977 2/20 0.45
S1PR1 P21453 2/20 0.45
S1PR3 Q99500 2/20 0.45
ZDHHC20 Q5W0Z9 1/20 0.45
ZDHHC2 Q9UIJ5 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
SCHEMBL303653 1.00 EPHX1 (1.00) EPHX1ADH1BADH1AADH7ADH1C
SCHEMBL145544 1.00 EPHX1 (1.00) EPHX1ADH1BADH1AADH7ADH1C
SCHEMBL9660807 1.00 EPHX1 (1.00) EPHX1ADH1BADH1AADH7ADH1C
SCHEMBL9661679 1.00 EPHX1 (1.00) EPHX1ADH1BADH1AADH7ADH1C
SCHEMBL302735 1.00 EPHX1 (1.00) EPHX1ADH1BADH1AADH7ADH1C
SCHEMBL9661848 1.00 EPHX1 (1.00) EPHX1ADH1BADH1AADH7ADH1C
SCHEMBL58363 1.00
SCHEMBL9658779 1.00 EPHX1 (1.00) EPHX1ADH1BADH1AADH7ADH1C
SCHEMBL4879688 1.00 EPHX1 (1.00) EPHX1ADH1BADH1AADH7ADH1C
SCHEMBL149028 1.00 EPHX1 (1.00) EPHX1ADH1BADH1AADH7ADH1C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240033189-A1 METHOD FOR PRODUCING A PERSONALIZED COSMETIC PREPARATION BASF SE (DE) 2024-02-01 US disclosed
US-20230240432-A1 METHOD FOR PRODUCING PERSONALIZED COSMETICS BASF SE (DE) 2023-08-03 US disclosed
WO-2023117874-A1 ENVIRONMENTAL ATTRIBUTES FOR COSMETIC INGREDIENTS BASF SE (DE) 2023-06-29 WO disclosed
EP-2282735-B1 PP2A MODULATORS FOR TREATING ALZHEIMER, PARKINSON, DIABETES SIGNUM BIOSCIENCES INC (US) 2019-01-16 EP disclosed
US-9255070-B2 Method of deuteration using mixed catalyst WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2016-02-09 US disclosed
US-9198432-B2 1,2,4-triazolyl-substituted ketoenols BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-12-01 US disclosed
US-9045390-B2 Haloalkylmethyleneoxyphenyl-substituted ketoenols BAYER CROPSCIENCE AG (DE) 2015-06-02 US disclosed
US-20140302988-A1 1,2,4-Triazolyl-Substituted Ketoenols BAYER INTELLECTUAL PROPERTY GMBH (DE) 2014-10-09 US disclosed
US-20140213813-A9 Haloalkylmethyleneoxyphenyl-Substituted Ketoenols BAYER INTELLECTUAL PROPERTY GMBH (DE) 2014-07-31 US disclosed
US-20140031577-A1 Haloalkylmethyleneoxyphenyl-Substituted Ketoenols BAYER INTELLECTUAL PROPERTY GMBH (DE) 2014-01-30 US disclosed
US-5047540-A Platelet Activating Factor Antagonists and Antitumor Agents SHIONOGI & CO., LTD. (JP) 1991-09-10 US disclosed
US-4994453-A Treating asthma, diabetes, obesity, immunosuppression FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-02-19 US disclosed
US-4925849-A DIURETICS, HYPOTENSIVE AGENTS, CARIOTONIC AGENTS AND ANTIEDEMIC AGENTS FUJISAWA PHARMACEUTICAL COMPANY, LTD. (JP) 1990-05-15 US disclosed
US-4880576-A HALOGENATION OF ACIDS, FORMAMIDE CATALYSTS BAYER AKTIENGESELLSCHAFT (DE) 1989-11-14 US disclosed
EP-0321296-A1 Lipid derivatives their preparation and use SHIONOGI SEIYAKU KABUSHIKI KAISHA trading under the name of SHIONOGI & CO. LTD. (JP) 1989-06-21 EP disclosed
EP-0306025-A2 Process for producing polyarylene sulfide IDEMITSU PETROCHEMICAL CO. LTD. (JP) 1989-03-08 EP disclosed
US-4777283-A Process for the preparation of alkoxycarbonyl isocyanates BAYER AKTIENGESELLSCHAFT (DE) 1988-10-11 US disclosed
US-4504472-A MICROBIOCIDES, IMMUNOSTIMULANTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1985-03-12 US disclosed
EP-0050779-B1 N-ALKYLATED FORMAMIDES, PROCESS FOR THEIR PREPARATION AND THEIR USE BAYER AG (DE) 1984-05-16 EP disclosed
EP-0050779-A1 N-alkylated formamides, process for their preparation and their use BAYER AG (DE) 1982-05-05 EP 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 (5 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-20230240432-A1 METHOD FOR PRODUCING PERSONALIZED COSMETICS CUTA, TYR, SUCLG1 EPHX1 318/4885ADH1B 20/4885ADH1A 200/4885
US-20140302988-A1 1,2,4-Triazolyl-Substituted Ketoenols PIKFYVE, PHYKPL, KCNE1 EPHX1 1786/4885ADH1B 4351/4885ADH1A 3424/4885
US-20240033189-A1 METHOD FOR PRODUCING A PERSONALIZED COSMETIC PREPARATION CUTA, NISCH, TYR EPHX1 477/4885ADH1B 63/4885ADH1A 514/4885
US-20140213813-A9 Haloalkylmethyleneoxyphenyl-Substituted Ketoenols PHYKPL, KCNE1, CSNK1E EPHX1 506/4885ADH1B 3777/4885ADH1A 3410/4885
US-20140031577-A1 Haloalkylmethyleneoxyphenyl-Substituted Ketoenols PHYKPL, KCNE1, CSNK1E EPHX1 506/4885ADH1B 3777/4885ADH1A 3410/4885

“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.