SCHEMBL602198

SCHEMBL602198

FC(F)(F)c1[c]c(C(F)(F)F)ncc1

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NOS3 P29474 1/20 0.38
NOS2 P35228 1/20 0.38
LOXL2 Q9Y4K0 1/20 0.31

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
SCHEMBL1881445 0.77 NOS3 (0.38) NOS3NOS2LOXL2
SCHEMBL1886344 0.77 NOS3 (0.38) NOS3NOS2LOXL2
SCHEMBL791272 0.76 NOS3 (0.36) NOS3NOS2
SCHEMBL790082 0.76 NOS3 (0.36) NOS3NOS2
SCHEMBL8307241 0.76 NOS3 (0.36) NOS3NOS2
SCHEMBL8304809 0.76 NOS3 (0.36) NOS3NOS2
SCHEMBL5252803 0.72 NOS3 (0.34) NOS3NOS2
SCHEMBL1707520 0.71 NOS3 (0.33) NOS3NOS2
SCHEMBL22653643 0.71 NOS3 (0.33) NOS3NOS2
SCHEMBL1706799 0.71 NOS3 (0.33) NOS3NOS2LOXL2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240041854-A1 COLD MEDICINE AND ANTIVIRAL MEDICINE OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 2024-02-08 US disclosed
EP-4190329-A1 COLD REMEDY AND ANTIVIRAL AGENT Otsuka Pharmaceutical Factory, Inc. (JP) 2023-06-07 EP disclosed
CN-102428082-A Pyrimidine compounds and their use in pest control SUMITOMO CHEMICAL CO 2012-04-25 CN disclosed
US-20120041009-A1 PYRIMIDINE COMPOUND AND ITS USE IN PEST CONTROL SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-02-16 US disclosed
WO-2010134478-A1 PYRIMIDINE COMPOUND AND ITS USE IN PEST CONTROL SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-11-25 WO disclosed
EP-1417202-A2 AMINOPIPERIDINE DERIVATIVES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY F. HOFFMANN-LA ROCHE AG (CH) 2004-05-12 EP disclosed
US-20030069276-A1 Amino piperidine derivatives F.HOFFMANN-LA ROCHE AG (CH) 2003-04-10 US disclosed
WO-2002079186-A2 AMINOPIPERIDINE DERIVATIVES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY F. HOFFMANN-LA ROCHE AG (CH) 2002-10-10 WO disclosed
EP-0576251-B1 Substituted 1,2,4-triazine-3,5-dione derivatives and drug compositions containing them, particularly for coccidiosis treatment SUNTORY LTD (JP) 1999-11-24 EP disclosed
US-5424310-A Substituted 1,2,4-triazine-3,5-dione derivative and anticoccidial drug composition containing the same as active component SUNTORY LIMITED (JP) 1995-06-13 US disclosed
EP-0576251-A1 Substituted 1,2,4-triazine-3,5-dione derivatives and drug compositions containing them, particularly for coccidiosis treatment SUNTORY LIMITED (JP) 1993-12-29 EP disclosed
EP-0277915-B1 PHOTOINITIATOR MIXTURE CONTAINING A TITANOCENE AND A 3-KETOCOUMARIN CIBA-GEIGY AG (CH) 1991-09-04 EP disclosed
US-5011755-A Relief Images CIBA-GEIGY CORPORATION (US) 1991-04-30 US disclosed
EP-0277915-A2 Photoinitiator mixture containing a titanocene and a 3-ketocoumarin CIBA-GEIGY AG (CH) 1988-08-10 EP 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 (3 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-20240041854-A1 COLD MEDICINE AND ANTIVIRAL MEDICINE IRF3, MAVS, EIF2AK2 NOS3 1459/4885NOS2 1534/4885LOXL2 4482/4885
US-20030069276-A1 Amino piperidine derivatives CCR5, CCR2, CXCR4 NOS3 1902/4885NOS2 1152/4885LOXL2 4527/4885
US-20120041009-A1 PYRIMIDINE COMPOUND AND ITS USE IN PEST CONTROL TYMP, DPYD, TYMS NOS3 3485/4885NOS2 1933/4885LOXL2 1911/4885

“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.