SCHEMBL22061397

SCHEMBL22061397

CC(C)(CN=O)n1cc(N)cn1

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
KIT P10721 1/20 0.33

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
SCHEMBL22061450 0.79 ALDH1A1 (0.33)
SCHEMBL15652485 0.78 KIT (0.49) KIT
SCHEMBL16423182 0.77 KIT (0.35) KIT
SCHEMBL15650977 0.75 KDM5B (0.39) KIT
SCHEMBL573656 0.74 MAPT (0.33)
SCHEMBL16423791 0.71 KIT (0.32) KIT
SCHEMBL23229773 0.70 PDK2 (0.39) KIT
SCHEMBL15059198 0.70 PDK2 (0.38) KIT
SCHEMBL23210319 0.70
SCHEMBL16423792 0.70 JAK2 (0.32) KIT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020112700-A1 9-SUBSTITUTED AMINO TRIAZOLO QUINAZOLINE DERIVATIVES AS ADENOSINE RECEPTOR ANTAGONISTS, PHARMACEUTICAL COMPOSITIONS AND THEIR USE MERCK SHARP & DOHME CORP. (US) 2020-06-04 WO disclosed