SCHEMBL2741827

SCHEMBL2741827

CON(C)C(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.49
SLC9A1 P19634 1/20 0.49
PKM P14618 1/20 0.45
RAB9A P51151 1/20 0.45
FAAH O00519 1/20 0.45
MCL1 Q07820 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.42
GPR88 Q9GZN0 1/20 0.42

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
SCHEMBL225811 1.00 EPHX2 (0.49) EPHX2SLC9A1PKMRAB9AFAAH
SCHEMBL225810 1.00 EPHX2 (0.49) EPHX2SLC9A1PKMRAB9AFAAH
SCHEMBL15254635 0.85 EPHX2 (0.52) EPHX2SLC9A1MCL1L3MBTL1GPR88
SCHEMBL6250729 0.85 MAPT (0.51) EPHX2RAB9AMCL1L3MBTL1GPR88
SCHEMBL5683647 0.85 EPHX2 (0.52) EPHX2SLC9A1MCL1L3MBTL1GPR88
SCHEMBL15254908 0.85 EPHX2 (0.52) EPHX2SLC9A1MCL1L3MBTL1GPR88
SCHEMBL17590033 0.84 MCL1 (0.55) EPHX2SLC9A1MCL1GPR88
SCHEMBL15208924 0.84 MCL1 (0.55) EPHX2SLC9A1MCL1GPR88
SCHEMBL17146213 0.84 MCL1 (0.55) EPHX2SLC9A1MCL1GPR88
SCHEMBL13929891 0.84 MCL1 (0.55) EPHX2SLC9A1MCL1GPR88

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230144767-A1 TARGETED NITROXIDE AGENTS UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2023-05-11 US disclosed
US-9890192-B2 Targeted nitroxide agents University of Pittsburgh—of the Commonwealth System of Higher Education (US) 2018-02-13 US disclosed
US-9732105-B2 Targeted nitroxide agents University of Pittsburgh—of the Commonwealth System of Higher Education (US) 2017-08-15 US disclosed
US-20160137692-A1 TARGETED NITROXIDE AGENTS UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2016-05-19 US disclosed
US-20160068556-A1 TARGETED NITROXIDE AGENTS UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2016-03-10 US disclosed
US-9220711-B2 Compounds for the treatment of pathologies associated with aging and degenerative disorders University of Pittsburgh—of the Commonwealth System of Higher Education (US) 2015-12-29 US disclosed
US-9216976-B2 Targeted nitroxide agents University of Pittsburgh—of the Commonwealth System of Higher Education (US) 2015-12-22 US disclosed
US-8937086-B2 Compounds for the treatment of pathologies associated with aging and degenerative disorders University of Pittsburgh—of the Commonwealth System of Higher Education (US) 2015-01-20 US disclosed
US-20140378444-A1 TARGETED NITROXIDE AGENTS UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2014-12-25 US disclosed
US-8822541-B2 Use of targeted nitroxide agents in mitigating or treating radiation injury University of Pittsburgh—of the Commonwealth System of Higher Education (US) 2014-09-02 US disclosed
US-20140018317-A1 TARGETED NITROXIDE AGENTS UNIVERSITY OF PITTSBURGH-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2014-01-16 US disclosed
US-8487079-B2 Use of mitochondria-targeted electron scavengers as anti-inflammatory agents University of Pittsburgh—of the Commonwealth System of Higher Education (US) 2013-07-16 US disclosed
US-20130102626-A1 TARGETED NITROXIDE AGENTS UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION 2013-04-25 US disclosed
US-8288551-B2 Targeted nitroxide agents UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2012-10-16 US disclosed
US-20120004263-A1 Compounds for the treatment of pathologies associated with aging and degenerative disorders UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2012-01-05 US disclosed
US-20110172214-A1 USE OF TARGETED NITROXIDE AGENTS IN PREVENTING, MITIGATING AND TREATING RADIATION INJURY UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION 2011-07-14 US disclosed
US-20100035869-A1 TARGETED NITROXIDE AGENTS PITTSBURGH-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION, UNIVERSITY OF 2010-02-11 US disclosed
US-20090042808-A1 USE OF MITOCHONDRIA-TARGETED ELECTRON SCAVENGERS AS ANTI-INFLAMMATORY AGENTS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2009-02-12 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 (10 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-20110172214-A1 USE OF TARGETED NITROXIDE AGENTS IN PREVENTING, MITIGATING AND TREATING RADIATION INJURY TXNRD2, TXN2, HSPE1 EPHX2 2186/4885SLC9A1 2168/4885PKM 1140/4885
US-20160137692-A1 TARGETED NITROXIDE AGENTS TXNRD2, TXN2, HSPE1 EPHX2 2346/4885SLC9A1 2325/4885PKM 1205/4885
US-20120004263-A1 Compounds for the treatment of pathologies associated with aging and degenerative disorders GLA, AGER, SIRT1 EPHX2 3558/4885SLC9A1 3641/4885PKM 979/4885
US-20090042808-A1 USE OF MITOCHONDRIA-TARGETED ELECTRON SCAVENGERS AS ANTI-INFLAMMATORY AGENTS HAGH, COX5B, HSPE1 EPHX2 3231/4885SLC9A1 3025/4885PKM 1931/4885
US-20100035869-A1 TARGETED NITROXIDE AGENTS TXNRD2, TXN2, HSPE1 EPHX2 2346/4885SLC9A1 2325/4885PKM 1205/4885
US-20230144767-A1 TARGETED NITROXIDE AGENTS TXNRD2, TXN2, HSPE1 EPHX2 2346/4885SLC9A1 2325/4885PKM 1205/4885
US-20140018317-A1 TARGETED NITROXIDE AGENTS NOXO1, NOX1, TPX2 EPHX2 738/4885SLC9A1 2541/4885PKM 3180/4885
US-20140378444-A1 TARGETED NITROXIDE AGENTS TXNRD2, TXN2, HSPE1 EPHX2 2346/4885SLC9A1 2325/4885PKM 1205/4885
US-20160068556-A1 TARGETED NITROXIDE AGENTS NOXO1, NOX1, TPX2 EPHX2 738/4885SLC9A1 2541/4885PKM 3180/4885
US-20130102626-A1 TARGETED NITROXIDE AGENTS TXNRD2, TXN2, HSPE1 EPHX2 2346/4885SLC9A1 2325/4885PKM 1205/4885

“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.