SCHEMBL28477252

SCHEMBL28477252

N#Cc1cccc(Nc2nc(Cl)ncc2Cl)c1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SYK P43405 2/20 0.55
ABCG2 Q9UNQ0 8/20 0.50
TP53 P04637 1/20 0.47
MAPT P10636 1/20 0.47
CDC7 O00311 1/20 0.46
EGFR P00533 3/20 0.45
BCL6 P41182 1/20 0.44
FLT1 P17948 1/20 0.44
FLT4 P35916 1/20 0.44
KDR P35968 1/20 0.44
ZAP70 P43403 1/20 0.44
F9 P00740 1/20 0.44
CTSC P53634 1/20 0.43

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
SCHEMBL655941 0.86 SYK (0.74) SYKABCG2TP53MAPTCDC7
SCHEMBL2627208 0.82 SYK (0.54) SYKABCG2MAPTZAP70
SCHEMBL2062260 0.80 BCL6 (0.42) EGFRBCL6CTSC
SCHEMBL4175833 0.80 BCL6 (0.56) SYKMAPTEGFRBCL6CTSC
SCHEMBL20752146 0.79 LRRK2 (0.65) SYKABCG2CDC7ZAP70CTSC
SCHEMBL9945497 0.78 EGFR (0.64) EGFRBCL6CTSC
SCHEMBL30394423 0.78 CTSC (0.52) SYKABCG2EGFRBCL6KDR
SCHEMBL30378026 0.78 BCL6 (0.48) ABCG2EGFRBCL6CTSC
SCHEMBL13669814 0.78 BCL6 (0.48) ABCG2EGFRBCL6CTSC
SCHEMBL30394764 0.78 EGFR (0.64) EGFRBCL6CTSC

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
CN-111718325-A 2,4, 5-substituted pyrimidine compound and preparation method and application thereof 烟台药物研究所 2020-09-29 CN disclosed