SCHEMBL3115288

SCHEMBL3115288

CN(c1ccncc1)c1ncccc1C(=O)Nc1ccc(C(C)(C)C)cc1

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 1/20 0.49
TRPV1 Q8NER1 11/20 0.47
KMT2A Q03164 1/20 0.47
PRKCI P41743 1/20 0.47
KDR P35968 1/20 0.47
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45

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
SCHEMBL3123929 0.82 KDR (0.59) TRPV1KMT2APRKCIKDRNPC1
SCHEMBL3115333 0.82 KMT2A (0.46) KMT2APRKCIKDRNPC1RAB9A
SCHEMBL3110688 0.81 RXFP1 (0.57) KMT2AKDR
SCHEMBL7134460 0.81 KDR (0.64) TRPV1KMT2APRKCIKDRNPC1
SCHEMBL3107870 0.81 KDR (0.50) TRPV1KDR
SCHEMBL3118019 0.80 KDR (0.60) TRPV1KMT2APRKCIKDRNPC1
SCHEMBL3119139 0.79 GRM4 (0.55) TRPV1KMT2AKDR
SCHEMBL3114991 0.79 KDR (0.52) TRPV1KMT2AKDR
SCHEMBL3112582 0.78 MAPT (0.49) KMT2AKDRNPC1RAB9A
SCHEMBL444553 0.78 TRPV1 (0.60) NAMPTTRPV1

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 4 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 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

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 NAMPT 30/4885TRPV1 1662/4885KMT2A 2155/4885

“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.