SCHEMBL1425902

SCHEMBL1425902

O=c1ccn([C@H]2C[C@@H]3OP(=O)(O)OC[C@H]3O2)c(=O)[nH]1

nearest known ligand 0.66

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
DHFR P00374 1/20 0.66
STING1 Q86WV6 14/20 0.47
DUT P33316 3/20 0.41

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
SCHEMBL16575809 0.80 DHFR (0.46) DHFRSTING1DUT
SCHEMBL2408425 0.80 DHFR (0.75) DHFRSTING1
SCHEMBL30968383 0.80 DHFR (1.00) DHFRSTING1
SCHEMBL1619438 0.80 DHFR (1.00) DHFRSTING1
SCHEMBL16558263 0.80 DHFR (1.00) DHFRSTING1
SCHEMBL21284217 0.79 STING1 (0.71) STING1
SCHEMBL18456892 0.79 DHFR (0.43) DHFRSTING1DUT
SCHEMBL29359340 0.78 STING1 (0.56) STING1
SCHEMBL3225428 0.78 DHFR (0.62) DHFRSTING1
SCHEMBL3215086 0.78 DHFR (0.56) DHFRSTING1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100087388-A1 ODCASE INHIBITORS AS ANTI-VIRALS AND ANTIBIOTICS KOTRA LAKSHMI P 2010-04-08 US claimed
WO-2007038860-A2 ODCASE INHIBITORS AS ANTI-VIRALS AND ANTIBIOTICS UNIVERSITY HEALTH NETWORK (CA) 2007-04-12 WO claimed
US-20220226239-A1 POLYMERIC MICELLE COMPLEXES, FORMULATIONS, AND USES THEREOF ARAVASC INC. (US) 2022-07-21 US disclosed
US-8410075-B2 Mannich base N-oxide drugs CASCADE PRODRUG INC. (US) 2013-04-02 US disclosed
US-8293240-B2 Method of treating drug-resistant cancer THE REGENTS OF THE UNIVERSITY OF COLORADO (US) 2012-10-23 US disclosed
US-20110206755-A1 METHODS AND PRODUCTS FOR MANIPULATING UNCOUPLING PROTEIN EXPRESSION THE UNIVERSITY OF VERMONT AND STATE AGRICULTURAL COLLEGE (US) 2011-08-25 US disclosed
EP-1545519-B1 COMBINATION THERAPY FOR HYPERPROLIFERATIVE DISEASES PFIZER (US) 2011-03-23 EP disclosed
US-7816319-B2 Methods and products for manipulating uncoupling protein expression UNIVERSITY OF VERMONT AND STATE AGRICULTURAL COLLEGE (US) 2010-10-19 US disclosed
US-20100087388-A1 ODCASE INHIBITORS AS ANTI-VIRALS AND ANTIBIOTICS KOTRA LAKSHMI P 2010-04-08 US disclosed
US-20100016252-A1 Mannich Base N-Oxide Drugs State of Oregon Acting By and Through The Oregon State Board of Higher Education On Behalf of The U (US) 2010-01-21 US disclosed
EP-2136626-A1 MANNICH BASE N-OXIDE DRUGS State of Oregon acting by and through the Oregon State Board of Higher Education on behalf of the University of Oregon (US) 2009-12-30 EP disclosed
US-20060140953-A1 Systems and methods for treating human inflammatory and proliferative diseases and wounds, with UCP and/or FAS antibody or other inhibitor, optionally with a fatty acid metabolism inhibitor and/or a glucose metabolism inhibitor NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2006-06-29 US disclosed
WO-2005070126-A2 METHODS AND COMPOSITIONS FOR TREATING HUMAN DISEASES AND WOUNDS WITH UCP AND FAS INHIBITORS THE REGENTS OF THE UNIVERSITY OF COLORADO (US) 2005-08-04 WO disclosed
EP-1194168-A2 METHODS AND PRODUCTS FOR MANIPULATING UNCOUPLING PROTEIN EXPRESSION UNIVERSITY OF VERMONT AND STATE AGRICULTURAL COLLEGE (US) 2002-04-10 EP disclosed
US-6342485-B1 ANTITUMOR AGENTS WITH NUCLEIC ACIDS GMEINER, WILLIAM H. 2002-01-29 US disclosed
WO-2000078941-A2 METHODS AND PRODUCTS FOR MANIPULATING UNCOUPLING PROTEIN EXPRESSION UNIVERSITY OF VERMONT AND STATE AGRICULTURAL COLLEGE (US) 2000-12-28 WO disclosed
US-5741900-A REACTING PROTECTED FLUOROURIDINE WITH SUCCINIC ANHYDRIDE, ATTACHING TO LONG-CHAIN ALKYLAMINE CONTROLLED PORE GLASS IN ANHYDROUS PYRIDINE IN PRESENCE OF DIMETHYLAMINOPYRIDINE AND DIMETHYLAMINOPROPYL/ETHYLCARBODIIMIDE THE BOARD OF REGENTS OF THE UNIVERSITY OF NEBRASKA (US) 1998-04-21 US disclosed
US-5663321-A INHIBITOR OF THYMIDYLATE SYNTHASE; ANTICANCER/ANTITUMOR AGENTS THE BOARD OF REGENTS OF THE UNIVERSITY OF NEBRASKA (US) 1997-09-02 US disclosed
US-5614505-A 5-FLUOROURIDINE OR 5-FLUORODEOXYURIDINE, DRUG DELIVERY, IMPROVED BIOAVAILABILITY, ANTICARCINOGENIC AGENTS THE BOARD OF REGENTS OF THE UNIVERSITY OF NEBRASKA (US) 1997-03-25 US disclosed
US-5457187-A Antitumor, anticarcinogeic agents BOARD OF REGENTS UNIVERSITY OF NEBRASKA (US) 1995-10-10 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 (4 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-20100087388-A1 ODCASE INHIBITORS AS ANTI-VIRALS AND ANTIBIOTICS ITPA, DUT, MAOA DHFR 73/4885STING1 798/4885DUT 2/4885
US-20220226239-A1 POLYMERIC MICELLE COMPLEXES, FORMULATIONS, AND USES THEREOF PHOSPHO1, MUC1, MCL1 DHFR 2633/4885STING1 3816/4885DUT 4502/4885
US-20100016252-A1 Mannich Base N-Oxide Drugs ASAH2, MAN2B1, NNT DHFR 540/4885STING1 3332/4885DUT 160/4885
US-20060140953-A1 Systems and methods for treating human inflammatory and proliferative diseases and wounds, with UCP and/or FAS antibody or other inhibitor, optionally with a fatty acid metabolism inhibitor and/or a glucose metabolism inhibitor FASN, FFAR2, FFAR1 DHFR 104/4885STING1 2875/4885DUT 652/4885

“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.