SCHEMBL6060246

SCHEMBL6060246

COC(=O)C(C(F)(F)CF)(C(F)(F)CF)P(=O)(O)O

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 2/20 0.37
PGK1 P00558 2/20 0.32
PGK2 P07205 2/20 0.32
GAA P10253 1/20 0.30

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
SCHEMBL3322447 0.68
SCHEMBL171079 0.67 PTPN1 (0.38) PTPN1PGK1PGK2
SCHEMBL1012634 0.65 DGAT1 (0.42) GAA
SCHEMBL18116696 0.64 DGAT1 (0.33) GAA
SCHEMBL11207116 0.64 DGAT1 (0.33) GAA
SCHEMBL8669260 0.64 DGAT1 (0.38) GAA
SCHEMBL4812438 0.64 PTPN1 (0.36) PTPN1PGK1PGK2
SCHEMBL1938870 0.63
SCHEMBL992 0.63 DGAT1 (0.41) PTPN1PGK1PGK2
SCHEMBL16863947 0.63 GAA (0.47) GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7012098-B2 Inhibitors of inducible nitric oxide synthase for chemoprevention and treatment of cancers PHARMACIA CORPORATION (US) 2006-03-14 US disclosed
EP-1463495-A4 AGENTS AND METHODS FOR TREATMENT OF CANCER PHARMACIA CORP (US) 2005-11-16 EP disclosed
US-20050203082-A1 Combination therapy with inhibitors of inducible nitric oxide synthase and alkylating agents PHARMACIA CORPORATION 2005-09-15 US disclosed
EP-1528921-A2 METHODS FOR TREATMENT AND PREVENTION OF GASTROINTESTINAL CONDITIONS Pharmacia Corporation (US) 2005-05-11 EP disclosed
WO-2005025620-A2 COMBINATION THERAPY WITH INHIBITORS OF INDUCIBLE NITRIC OXIDE SYNTHASE AND ALKYLATING AGENTS PHARMACIA CORPORATION (US) 2005-03-24 WO disclosed
EP-1506040-A2 SELECTIVE INOS INHIBITORS FOR THE TREATMENT OF RESPIRATORY DISEASES AND CONDITIONS Pharmacia Corporation (US) 2005-02-16 EP disclosed
EP-1505972-A2 A SELECTIVE INOS INHIBITOR AND A PDE INHIBITOR IN COMBINATION FOR THE TREATMENT OF RESPIRATORY DISEASES Pharmacia Corporation (US) 2005-02-16 EP disclosed
EP-1463495-A2 AGENTS AND METHODS FOR TREATMENT OF CANCER Pharmacia Corporation (US) 2004-10-06 EP disclosed
US-20040127569-A1 Methods for treatment and prevention of gastrointestinal conditions PHARMACIA CORPORATION 2004-07-01 US disclosed
EP-1429752-A1 NEUROPROTECTIVE TREATMENT METHODS USING SELECTIVE INOS INHIBITORS Pharmacia Corporation (US) 2004-06-23 EP disclosed
WO-2004012726-A2 METHODS FOR TREATMENT AND PREVENTION OF GASTROINTESTINAL CONDITIONS PHARMACIA CORPORATION (US) 2004-02-12 WO disclosed
WO-2003097163-A2 USING A SELECTIVE INOS INHIBITOR FOR THE TREATMENT OF RESPIRATORY DISEASES AND CONDITIONS PHARMACIA CORPORATION (US) 2003-11-27 WO disclosed
WO-2003097050-A2 A SELECTIVE INOS INHIBITOR AND A PDE INHIBITOR IN COMBINATION FOR THE TREATMENT OF RESPIRATORY DISEASES PHARMACIA CORPORATION (US) 2003-11-27 WO disclosed
US-20030119826-A1 Neuroprotective treatment methods using selective iNOS inhibitors PHARMACIA CORPORATION 2003-06-26 US disclosed
US-20030109522-A1 Ophthalmologic treatment methods using selective iNOS inhibitors PHARMACIA CORPORATION 2003-06-12 US disclosed
US-6545170-B2 For therapy of rheumatoid arthritis and in osteoarthritis, inflammatory bowel disease, cardivascular ischemia, diabetes, congestive heart failure, myocarditis, atherosclerosis, migraine, glaucoma, aortic aneurysm, reflux esophagitis PHARMACIA CORPORATION 2003-04-08 US disclosed
WO-2003026638-A1 NEUROPROTECTIVE TREATMENT METHODS USING SELECTIVE INOS INHIBITORS PHARMACIA CORPORATION (US) 2003-04-03 WO disclosed
US-20030013702-A1 Agents and methods for treatment of cancer PHARMACIA CORPORATION 2003-01-16 US disclosed
WO-2002076395-A2 AGENTS AND METHODS FOR TREATMENT OF CANCER PHARMACIA CORPORATION (US) 2002-10-03 WO disclosed
US-20020143061-A1 2-amino-5, 6 heptenoic acid derivatives useful as nitric oxide synthase inhibitors PITZELE BARNETT S (US) 2002-10-03 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 (6 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-20030013702-A1 Agents and methods for treatment of cancer FAP, APC, PTGIS PTPN1 1539/4885PGK1 1660/4885PGK2 1083/4885
US-20050203082-A1 Combination therapy with inhibitors of inducible nitric oxide synthase and alkylating agents NOS2, NOS1, NOS3 PTPN1 3997/4885PGK1 2442/4885PGK2 1944/4885
US-20040127569-A1 Methods for treatment and prevention of gastrointestinal conditions SI, NOS2, NOS3 PTPN1 2984/4885PGK1 1182/4885PGK2 1375/4885
US-20030109522-A1 Ophthalmologic treatment methods using selective iNOS inhibitors NOS2, NOS1, NOS3 PTPN1 3701/4885PGK1 1402/4885PGK2 1299/4885
US-20030119826-A1 Neuroprotective treatment methods using selective iNOS inhibitors NOS2, NOS1, NLN PTPN1 4141/4885PGK1 2133/4885PGK2 2135/4885
US-20020143061-A1 2-amino-5, 6 heptenoic acid derivatives useful as nitric oxide synthase inhibitors PTGIS, NOS1, NOS2 PTPN1 2923/4885PGK1 1266/4885PGK2 1094/4885

“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.