SCHEMBL651374

SCHEMBL651374

O=[N+]([O-])c1ccc([C@H](O)[C@@H]2CO2)cc1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.49
KDM4E B2RXH2 1/20 0.46
HTR2A P28223 1/20 0.44
MAPT P10636 2/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
EPHX1 P07099 1/20 0.43
THRB P10828 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
NPC1 O15118 1/20 0.42
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA9 Q16790 1/20 0.42
CA14 Q9ULX7 1/20 0.42
GAA P10253 1/20 0.40
HPGD P15428 1/20 0.40
CES1 P23141 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
SCHEMBL1299034 1.00 ALDH1A1 (0.49) ALDH1A1KDM4EHTR2AMAPTMEN1
SCHEMBL28592383 1.00 ALDH1A1 (0.49) ALDH1A1KDM4EHTR2AMAPTMEN1
SCHEMBL6269049 0.79 HTR2A (0.59) ALDH1A1KDM4EHTR2AMAPTMEN1
SCHEMBL9156352 0.78 ALDH1A1 (0.40) ALDH1A1KDM4EMAPTMEN1KMT2A
SCHEMBL6807174 0.76 CA2 (0.44) ALDH1A1KMT2AEPHX1CA12CA1
SCHEMBL6807193 0.76 CA2 (0.44) ALDH1A1KMT2AEPHX1CA12CA1
SCHEMBL6808021 0.76 CA2 (0.44) ALDH1A1KMT2AEPHX1CA12CA1
SCHEMBL14384661 0.76 ALDH1A1 (0.57) ALDH1A1KDM4EHTR2AMAPTMEN1
SCHEMBL18256235 0.76 ALDH1A1 (0.57) ALDH1A1KDM4EHTR2AMAPTMEN1
SCHEMBL14384138 0.76 ALDH1A1 (0.57) ALDH1A1KDM4EHTR2AMAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0926951-B1 TREATING PULMONARY DISEASES MEDIATED BY POLYUNSATURATED LIPID METABOLITES AND ASSAYS FOR EPOXIDE HYDROLASE INHIBITORS UNIV CALIFORNIA (US) 2004-04-21 EP claimed
US-20030139469-A1 Use of inhibitors of soluble epoxide hydrolase to inhibit vascular smooth muscle cell proliferation THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2003-07-24 US claimed
EP-0926951-A4 METHODS OF TREATING PULMONARY DISEASES MEDIATED BY POLYUNSATURATED LIPID METABOLITES AND ASSAYS FOR EPOXIDE HYDROLASE INHIBITORS UNIV CALIFORNIA (US) 2001-08-08 EP claimed
EP-0926951-A1 METHODS OF TREATING PULMONARY DISEASES MEDIATED BY POLYUNSATURATED LIPID METABOLITES AND ASSAYS FOR EPOXIDE HYDROLASE INHIBITORS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1999-07-07 EP claimed
WO-1998006261-A1 METHODS OF TREATING PULMONARY DISEASES MEDIATED BY POLYUNSATURATED LIPID METABOLITES AND ASSAYS FOR EPOXIDE HYDROLASE INHIBITORS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1998-02-19 WO claimed
US-20230071934-A1 NOVEL USES INTRA-CELLULAR THERAPIES, INC. 2023-03-09 US disclosed
US-11123311-B2 Methods of treating mental disorders THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-09-21 US disclosed
WO-2021127517-A1 NOVEL USES INTRA-CELLULAR THERAPIES, INC. (US) 2021-06-24 WO disclosed
US-20210145891-A1 METHODS OF IMPROVING CELL-BASED THERAPY THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2021-05-20 US disclosed
US-20200197368-A1 METHODS OF IMPROVING CANCER CHEMOTHERAPY THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2020-06-25 US disclosed
US-10383835-B2 Treatment of inflammatory disorders in non-human mammals THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2019-08-20 US disclosed
US-20190125696-A1 METHODS OF TREATING MENTAL DISORDERS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2019-05-02 US disclosed
US-20080249055-A1 Use of Seh Inhibitors as Analgesics NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2008-10-09 US disclosed
US-20050222252-A1 Use of cis-Epoxyeicosantrienoic acids and inhibitors of soluble epoxide hydrolase to reduce pulmonary infiltration by neutrophils THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2005-10-06 US disclosed
EP-0926951-B1 TREATING PULMONARY DISEASES MEDIATED BY POLYUNSATURATED LIPID METABOLITES AND ASSAYS FOR EPOXIDE HYDROLASE INHIBITORS UNIV CALIFORNIA (US) 2004-04-21 EP disclosed
EP-0926951-A4 METHODS OF TREATING PULMONARY DISEASES MEDIATED BY POLYUNSATURATED LIPID METABOLITES AND ASSAYS FOR EPOXIDE HYDROLASE INHIBITORS UNIV CALIFORNIA (US) 2001-08-08 EP disclosed
US-6174695-B1 DETERMINING INTRACELLULAR CHANGE IN CALCIUM LEVELS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2001-01-16 US disclosed
US-5955496-A TREATING ADULT RESPIRATORY DISTRESS SYNDROME THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1999-09-21 US disclosed
EP-0926951-A1 METHODS OF TREATING PULMONARY DISEASES MEDIATED BY POLYUNSATURATED LIPID METABOLITES AND ASSAYS FOR EPOXIDE HYDROLASE INHIBITORS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1999-07-07 EP disclosed
WO-1998006261-A1 METHODS OF TREATING PULMONARY DISEASES MEDIATED BY POLYUNSATURATED LIPID METABOLITES AND ASSAYS FOR EPOXIDE HYDROLASE INHIBITORS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1998-02-19 WO 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 (7 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-20080249055-A1 Use of Seh Inhibitors as Analgesics EPHX1, FAAH, EPHX2 ALDH1A1 526/4885KDM4E 3401/4885HTR2A 2154/4885
US-20200197368-A1 METHODS OF IMPROVING CANCER CHEMOTHERAPY ALOX5, EPHX1, ALOX12 ALDH1A1 107/4885KDM4E 2392/4885HTR2A 1254/4885
US-20230071934-A1 NOVEL USES SMPD1, PDE4A, PDE7A ALDH1A1 1578/4885KDM4E 3635/4885HTR2A 3044/4885
US-11123311-B2 Methods of treating mental disorders FAAH, EPHX1, FAAH2 ALDH1A1 187/4885KDM4E 1449/4885HTR2A 397/4885
US-20210145891-A1 METHODS OF IMPROVING CELL-BASED THERAPY EPHX1, EPHX2, NCEH1 ALDH1A1 182/4885KDM4E 2385/4885HTR2A 3132/4885
US-20190125696-A1 METHODS OF TREATING MENTAL DISORDERS FAAH, EPHX1, FAAH2 ALDH1A1 187/4885KDM4E 1449/4885HTR2A 397/4885
US-10383835-B2 Treatment of inflammatory disorders in non-human mammals EPHX1, SERPINB1, PTGES ALDH1A1 375/4885KDM4E 2787/4885HTR2A 2462/4885

“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.