SCHEMBL15212078

SCHEMBL15212078

[CH2]CC1(C)CNc2cc(Nc3nc(Cl)ncc3F)ccc2O1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SYK P43405 15/20 0.43
JAK2 O60674 1/20 0.39
EGFR P00533 1/20 0.39
LCK P06239 1/20 0.39
LYN P07948 1/20 0.39
FGFR4 P22455 1/20 0.39
BCL6 P41182 4/20 0.37
NCOR2 Q9Y618 2/20 0.36

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
SCHEMBL15212485 0.81 SYK (0.53) SYKJAK2EGFRLCKLYN
SCHEMBL655687 0.77 SYK (0.64) SYKJAK2EGFRLCKLYN
SCHEMBL13007738 0.74 SYK (0.49) SYKJAK2EGFRLCKLYN
SCHEMBL656721 0.74 SYK (0.56) SYKJAK2EGFRLCKLYN
SCHEMBL15212360 0.74 SYK (0.49) SYKJAK2EGFRLCKLYN
SCHEMBL15212398 0.73 SYK (0.51) SYKJAK2EGFRLCKLYN
SCHEMBL4300310 0.72 SYK (0.67) SYKEGFR
SCHEMBL656863 0.71 SYK (0.43) SYKBCL6
SCHEMBL2103987 0.71 TRPV1 (0.51) SYKJAK2EGFRLCKLYN
SCHEMBL2103481 0.70 MAOB (0.51) SYKJAK2EGFRLCKLYN

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-2817306-A1 CYCLIC DIAMINOPYRIMIDINE DERIVATIVES Merck Patent GmbH (DE) 2014-12-31 EP disclosed
WO-2013126132-A1 CYCLIC DIAMINOPYRIMIDINE DERIVATIVES MERCK PATENT GMBH (DE) 2013-08-29 WO disclosed