SCHEMBL2509748

SCHEMBL2509748

c1ccc(CC2OC2c2ccccc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TLR9 Q9NR96 1/20 0.42
EPHX1 P07099 3/20 0.39
SLC5A2 P31639 3/20 0.39
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
SLC6A3 Q01959 1/20 0.39
CTRB1 P17538 1/20 0.39
FASN P49327 1/20 0.38
LMNA P02545 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
RECQL P46063 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
GBA1 P04062 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
SCHEMBL2509746 1.00 TLR9 (0.42) TLR9EPHX1SLC5A2SLC6A2SLC6A4
SCHEMBL31231840 0.80 TLR9 (0.47) TLR9SLC6A2SLC6A4SLC6A3CTRB1
SCHEMBL24989060 0.79 TSHR (0.48) SLC5A2
SCHEMBL11825236 0.78 FASN (0.47) SLC5A2SLC6A2SLC6A4SLC6A3FASN
SCHEMBL30450943 0.78 MAPT (0.42) SLC5A2LMNASMN1; SMN2
SCHEMBL21284279 0.76 EPHX1 (0.34) EPHX1SLC5A2SLC6A2SLC6A4SLC6A3
SCHEMBL3260343 0.74 SLC5A2 (0.50) EPHX1SLC5A2CYP1A2CYP2C9CYP2C19
SCHEMBL9475300 0.74 SLC5A2 (0.50) EPHX1SLC5A2CYP1A2CYP2C9CYP2C19
SCHEMBL11277296 0.74 TLR9 (0.43) TLR9SLC6A2SLC6A4SLC6A3CTRB1
SCHEMBL9486645 0.74 SLC5A2 (0.50) EPHX1SLC5A2CYP1A2CYP2C9CYP2C19

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 20 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8815951-B2 Inhibitors of epoxide hydrolases for the treatment of inflammation THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2014-08-26 US disclosed
US-20110245331-A1 INHIBITORS OF EPOXIDE HYDROLASES FOR THE TREATMENT OF HYPERTENSION THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2011-10-06 US disclosed
US-20080188554-A1 METHODS OF TREATING AVIAN HYPERTENSION REGENTS OF THE UNIVERSITY OF CALIFORNIA OFFICE OF TECHNOLOGY TRANSFER (US) 2008-08-07 US disclosed
US-20080188554-A1 METHODS OF TREATING AVIAN HYPERTENSION REGENTS OF THE UNIVERSITY OF CALIFORNIA OFFICE OF TECHNOLOGY TRANSFER (US) 2008-08-07 US disclosed
US-20070117782-A1 INHIBITORS OF EPOXIDE HYDROLASES FOR THE TREATMENT OF INFLAMMATION THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2007-05-24 US disclosed
US-20050282767-A1 Inhibitors of epoxide hydrolases for the treatment of hypertension THE REGENTS OF THE UNIVERSITY OF CALIFORNIA, OFFICE OF TECHNOLOGY TRANSFER (US) 2005-12-22 US disclosed
US-6756210-B2 DETECTING PRE-ECLAMPSIA, AND PREGNANCY-INDUCED HYPERTENSION BY WAY OF ABNORMAL REGULATION OF CYTOCHROME P450 METABOLISM; ENZYME INHIBITORS; OXIDOREDUCTASES; EPOXIDE HYDROLASES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2004-06-29 US disclosed
US-20040092487-A1 Inhibitors of epoxide hydrolases for the treatment of hypertension THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2004-05-13 US disclosed
US-6693130-B2 UREAS, AMIDES, AND CARBAMATES; DICYCLOHEXYL UREA REGENTS OF THE UNIVERSITY OF CALIFORNIA 2004-02-17 US disclosed
US-20030119900-A1 Inhibitors of epoxide hydrolases for the treatment of hypertension THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2003-06-26 US disclosed
US-20030113824-A1 Dihydroxy unsaturated fatty acid levels as diagnostic markers NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2003-06-19 US disclosed
EP-0724569-B1 PROCESS FOR THE PREPARATION OF AN OXIRANE, AZIRIDINE OR CYCLOPROPANE AVECIA LTD (GB) 2003-03-12 EP disclosed
US-6531506-B1 Inhibitors of epoxide hydrolases for the treatment of hypertension REGENTS OF THE UNIVERSITY OF CALIFORNIA 2003-03-11 US disclosed
US-5703246-A REACTING AN ORGANOMETALLIC COMPOUND WITH ORGANOSULFUR COMPOUND ZENECA LIMITED (GB) 1997-12-30 US disclosed
EP-0724569-A1 PROCESS FOR THE PREPARATION OF AN OXIRANE, AZIRIDINE OR CYCLOPROPANE ZENECA LIMITED (GB) 1996-08-07 EP disclosed
WO-1995011230-A1 PROCESS FOR THE PREPARATION OF AN OXIRANE, AZIRIDINE OR CYCLOPROPANE ZENECA LIMITED (GB) 1995-04-27 WO disclosed
US-4186255-A POLYURETHANE CATALYST TEXACO DEVELOPMENT CORPORATION (US) 1980-01-29 US disclosed
US-4136240-A METALLIC QUATERNARY AMMONIUM CARBOXYLATES AS POLYISOCYANURATE CATALYSTS TEXACO DEVELOPMENT CORPORATION (US) 1979-01-23 US disclosed
US-4075130-A DIAMINES, TRIAMINES TEXACO DEVELOPMENT CORPORATION (US) 1978-02-21 US disclosed
US-4060501-A Novolak derivatives as defoamers TEXACO DEVELOPMENT CORPORATION (US) 1977-11-29 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 (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-20110245331-A1 INHIBITORS OF EPOXIDE HYDROLASES FOR THE TREATMENT OF HYPERTENSION EPHX1, EPHX2, NCEH1 TLR9 4557/4885EPHX1 1/4885SLC5A2 2501/4885
US-20030119900-A1 Inhibitors of epoxide hydrolases for the treatment of hypertension EPHX1, NCEH1, EPHX2 TLR9 4524/4885EPHX1 1/4885SLC5A2 2588/4885
US-20080188554-A1 METHODS OF TREATING AVIAN HYPERTENSION EPHX1, ERH, EPHX2 TLR9 1821/4885EPHX1 1/4885SLC5A2 2146/4885
US-20030113824-A1 Dihydroxy unsaturated fatty acid levels as diagnostic markers ALOX12, ALOX15, ALOX5 TLR9 3782/4885EPHX1 15/4885SLC5A2 2629/4885
US-20040092487-A1 Inhibitors of epoxide hydrolases for the treatment of hypertension EPHX1, NCEH1, EPHX2 TLR9 4524/4885EPHX1 1/4885SLC5A2 2588/4885
US-20050282767-A1 Inhibitors of epoxide hydrolases for the treatment of hypertension EPHX1, EPHX2, NCEH1 TLR9 4571/4885EPHX1 1/4885SLC5A2 2477/4885
US-20070117782-A1 INHIBITORS OF EPOXIDE HYDROLASES FOR THE TREATMENT OF INFLAMMATION EPHX1, LTA4H, PTGS1 TLR9 2252/4885EPHX1 1/4885SLC5A2 3747/4885

“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.