SCHEMBL985175

SCHEMBL985175

NCc1ccc(Cc2nc3nc(N)[nH]c(=O)c3[nH]2)cc1

nearest known ligand 0.77

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PNP P00491 7/20 0.77
FGFR1 P11362 1/20 0.47
FGFR2 P21802 1/20 0.47

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
Hydrochloric Acid SCHEMBL2777605 0.99 PNP (0.75) PNPFGFR1FGFR2
Sulfuric Acid SCHEMBL17186613 0.94 PNP (0.68) PNPFGFR1FGFR2
SCHEMBL2777879 0.89 PNP (0.74) PNPFGFR1FGFR2
SCHEMBL3303807 0.89 PNP (0.77) PNPFGFR1FGFR2
Hydrochloric Acid SCHEMBL2775954 0.88 PNP (0.72) PNPFGFR1FGFR2
SCHEMBL3021038 0.87 PNP (0.75) PNPFGFR1FGFR2
SCHEMBL3308558 0.87 PNP (0.75) PNPFGFR1FGFR2
SCHEMBL1533546 0.87 PNP (0.75) PNP
SCHEMBL3310268 0.87 PNP (0.75) PNPFGFR1FGFR2
Hydrochloric Acid SCHEMBL17186489 0.87 PNP (0.75) PNPFGFR1FGFR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160230011-A1 CELL PERMEABLE, FLUORESCENT DYE ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (EPFL) (CH) 2016-08-11 US disclosed
US-8623627-B2 Labelling of fusion proteins with synthetic probes NEW ENGLAND BIOLABS, INC (US) 2014-01-07 US disclosed
US-20130130291-A1 Labelling of Fusion Proteins with Synthetic Probes ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (CH) 2013-05-23 US disclosed
EP-2049499-B1 LABELLING OF FUSION PROTEINS WITH SYNTHETIC PROBES EPFL ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (CH) 2012-10-31 EP disclosed
US-20120237961-A1 Labelling of Fusion Proteins with Synthetic Probes GAUTIER ARNAUD (CH) 2012-09-20 US disclosed
US-8227602-B2 Labelling of fusion proteins with synthetic probes ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (CH) 2012-07-24 US disclosed
US-20110207157-A1 Labelling of Fusion Proteins With Synthetic Probes ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (CH) 2011-08-25 US disclosed
US-20110165593-A1 Mutants of 06-Alkylguanine-DNA Alkyltransferase ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (CH) 2011-07-07 US disclosed
US-7888090-B2 reduced DNA interaction; localization of the expressed protein in eukaryotic cells that is no longer restricted to the nucleus; improved expression yield as soluble protein and improved stability in various hosts; oxidizing resistant;better in vitro solubility ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (CH) 2011-02-15 US disclosed
US-20110014196-A1 Drug Transfer into Living Cells COVALYS BIOSCIENCES AG (CH) 2011-01-20 US disclosed
US-20070207532-A1 Mutants Of O6-Alkylguanine-Dna Alkyltransferase EPFL ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (CH) 2007-09-06 US disclosed
US-20060292651-A1 Protein labelling with oº-alkylguanine-dna alkyltrnsferase ECOLE POLYTECHNIQUE FEDERAL DE LAUSANNE (EPFL) (CH) 2006-12-28 US disclosed
EP-1720981-A2 MUTANTS OF O6-ALKYLGUANINE-DNA ALKYLTRANSFERASE EPFL Ecole Polytechnique Fédérale de Lausanne (CH) 2006-11-15 EP disclosed
WO-2005085431-A9 MUTANTS OF O6-ALKYLGUANINE-DNA ALKYLTRANSFERASE EPFL ECOLE POLYTECHNIQUE FEDERALE LAUSANNE (CH) 2006-10-12 WO disclosed
US-20060024775-A1 Substrates for o6-alkylguanina-dna alkyltransferase ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (EPFL). (CH) 2006-02-02 US disclosed
WO-2005085431-A2 MUTANTS OF O6-ALKYLGUANINE-DNA ALKYLTRANSFERASE EPFL ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (CH) 2005-09-15 WO disclosed
EP-1546371-A1 SUBSTRATES FOR O6-ALKYLGUANINE-DNA ALKYLTRANSFERASE ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (EPFL) (CH) 2005-06-29 EP disclosed
EP-1546370-A1 PROTEIN LABELLING WITH O6-ALKYLGUANINE-DNA ALKYLTRANSFERASE ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (EPFL) (CH) 2005-06-29 EP disclosed
WO-2004031404-A1 PROTEIN LABELLING WITH O6-ALKYLGUANINE-DNA ALKYLTRANSFERASE ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (EPFL) (CH) 2004-04-15 WO disclosed
WO-2004031405-A1 SUBSTRATES FOR O6-ALKYLGUANINE-DNA ALKYLTRANSFERASE ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (EPFL) (CH) 2004-04-15 WO 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-20110014196-A1 Drug Transfer into Living Cells TSPO, MPI, ABCB1 PNP 112/4885FGFR1 1000/4885FGFR2 2330/4885
US-20160230011-A1 CELL PERMEABLE, FLUORESCENT DYE EPCAM, IK, TSPO PNP 4748/4885FGFR1 2991/4885FGFR2 2624/4885
US-20110207157-A1 Labelling of Fusion Proteins With Synthetic Probes GART, ALKBH2, ATIC PNP 132/4885FGFR1 2838/4885FGFR2 2385/4885
US-20060024775-A1 Substrates for o6-alkylguanina-dna alkyltransferase AGT, OGG1, NUDT1 PNP 176/4885FGFR1 2992/4885FGFR2 3601/4885

“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.