SCHEMBL8568476

SCHEMBL8568476

CC(C)(N)CNc1cc2c(Nc3cc(Br)c(N)c(Br)c3)ncnc2cn1

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EGFR P00533 19/20 0.47
ERBB2 P04626 2/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
TNK2 Q07912 1/20 0.46
MKNK1 Q9BUB5 1/20 0.46

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
SCHEMBL8566823 0.77 GRM1 (0.64) EGFRERBB2MEN1KMT2A
SCHEMBL8566778 0.72 CD38 (0.43) EGFRERBB2MEN1KMT2ATNK2
SCHEMBL8566783 0.72 CD38 (0.43) EGFRERBB2MEN1KMT2ATNK2
SCHEMBL8569905 0.69 GRM1 (0.55) EGFRERBB2MEN1KMT2A
SCHEMBL8819515 0.67 EGFR (0.74) EGFRERBB2MEN1KMT2ATNK2
SCHEMBL8570286 0.67 EGFR (0.59) EGFRERBB2
SCHEMBL22604128 0.66 EGFR (0.67) EGFRERBB2MEN1KMT2ATNK2
SCHEMBL6995684 0.65 EGFR (0.48) EGFRMKNK1
SCHEMBL22604135 0.64 EGFR (0.74) EGFRERBB2MEN1KMT2ATNK2
SCHEMBL29714897 0.64 EGFR (0.74) EGFRERBB2MEN1KMT2ATNK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0885226-A1 4-AMINO PYRIMIDINE DERIVATES, MEDICAMENTS CONTAINING THESE COMPOUNDS, THEIR USE AND PROCESS FOR THEIR PRODUCTION Dr. Karl Thomae GmbH (DE) 1998-12-23 EP disclosed
WO-1997032881-A1 4-AMINO PYRIMIDINE DERIVATES, MEDICAMENTS CONTAINING THESE COMPOUNDS, THEIR USE AND PROCESS FOR THEIR PRODUCTION DR. KARL THOMAE GMBH (DE) 1997-09-12 WO disclosed