SCHEMBL3109871

SCHEMBL3109871

O=C(Nc1cccc(C(F)(F)F)c1)c1cccnc1NCc1ccccc1

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 5/20 0.81
MEN1 O00255 2/20 0.81
MAPT P10636 2/20 0.81
KMT2A Q03164 2/20 0.81
L3MBTL1 Q9Y468 2/20 0.81
ALDH1A1 P00352 1/20 0.81
LMNA P02545 1/20 0.81
HPGD P15428 1/20 0.81
HTT P42858 1/20 0.81
NPSR1 Q6W5P4 1/20 0.81
KDR P35968 11/20 0.72
FLT1 P17948 2/20 0.66
ABL1 P00519 1/20 0.66
EGFR P00533 1/20 0.66
CSF1R P07333 1/20 0.66
PDGFRB P09619 1/20 0.66
KIT P10721 1/20 0.66
FLT4 P35916 1/20 0.66
KDM4E B2RXH2 1/20 0.60
PPIA P62937 1/20 0.58

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 SCHEMBL4405252 0.99 RXFP1 (0.80) RXFP1MEN1MAPTKMT2AL3MBTL1
SCHEMBL427615 0.93 KDR (0.84) RXFP1MEN1MAPTKMT2AL3MBTL1
SCHEMBL3106390 0.92 KDR (0.70) RXFP1MEN1MAPTKMT2AL3MBTL1
Hydrochloric Acid SCHEMBL447740 0.92 KDR (0.83) RXFP1MEN1MAPTKMT2AL3MBTL1
SCHEMBL3122487 0.91 RXFP1 (0.71) RXFP1MEN1MAPTKMT2AL3MBTL1
SCHEMBL3110637 0.89 KDR (0.66) RXFP1MEN1MAPTKMT2AL3MBTL1
SCHEMBL15528901 0.88 KDR (0.87) RXFP1MEN1MAPTKMT2AL3MBTL1
SCHEMBL3110867 0.87 RXFP1 (0.66) RXFP1MEN1MAPTKMT2AL3MBTL1
SCHEMBL3108780 0.87 KDR (0.66) RXFP1MEN1MAPTKMT2AL3MBTL1
SCHEMBL427746 0.86 RXFP1 (0.65) RXFP1MEN1MAPTKMT2AL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2168948-A1 2-AMINO-NICOTINAMIDE DERIVATIVES AND THEIR USE AS VEGF-RECEPTOR TYROSINE KINASE INHIBITORS Novartis AG (CH) 2010-03-31 EP claimed
EP-1259487-B1 2-AMINO-NICOTINAMIDE DERIVATIVES AND THEIR USE AS VEGF-RECEPTOR TYROSINE KINASE INHIBITORS NOVARTIS AG (CH) 2009-12-23 EP claimed
US-6624174-B2 Especially for treating a neoplastic disease, retinopathy or age-related macular degeneration NOVARTIS AG (CH) 2003-09-23 US claimed
US-20030032656-A1 2-Amino-nicotinamide derivatives and their use as vegf-receptor tyrosine kinase inhibitors NOVARTIS AG (CH) 2003-02-13 US claimed
EP-2168948-A1 2-AMINO-NICOTINAMIDE DERIVATIVES AND THEIR USE AS VEGF-RECEPTOR TYROSINE KINASE INHIBITORS Novartis AG (CH) 2010-03-31 EP disclosed
EP-1259487-B1 2-AMINO-NICOTINAMIDE DERIVATIVES AND THEIR USE AS VEGF-RECEPTOR TYROSINE KINASE INHIBITORS NOVARTIS AG (CH) 2009-12-23 EP disclosed
US-6624174-B2 Especially for treating a neoplastic disease, retinopathy or age-related macular degeneration NOVARTIS AG (CH) 2003-09-23 US disclosed
US-20030032656-A1 2-Amino-nicotinamide derivatives and their use as vegf-receptor tyrosine kinase inhibitors NOVARTIS AG (CH) 2003-02-13 US disclosed
EP-1259487-A1 2-AMINO-NICOTINAMIDE DERIVATIVES AND THEIR USE AS VEGF-RECEPTOR TYROSINE KINASE INHIBITORS Novartis AG (CH) 2002-11-27 EP disclosed
WO-2001055114-A1 2-AMINO-NICOTINAMIDE DERIVATIVES AND THEIR USE AS VEGF-RECEPTOR TYROSINE KINASE INHIBITORS NOVARTIS AG (CH) 2001-08-02 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 (1 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-20030032656-A1 2-Amino-nicotinamide derivatives and their use as vegf-receptor tyrosine kinase inhibitors KDR, ERBB2, FLT1 RXFP1 957/4885MEN1 4248/4885MAPT 618/4885

“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.