SCHEMBL19675893

SCHEMBL19675893

Cc1cnc(Nc2cccc(F)c2)nc1Nc1ccc2ncccc2c1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SYK P43405 5/20 0.55
ULK1 O75385 1/20 0.51
ULK2 Q8IYT8 1/20 0.51
EGFR P00533 4/20 0.49
AURKA O14965 3/20 0.49
TGFBR1 P36897 1/20 0.47
TP53 P04637 1/20 0.46
MAPT P10636 1/20 0.46
BTK Q06187 3/20 0.46
JAK3 P52333 2/20 0.46
ITK Q08881 1/20 0.45
BLK P51451 1/20 0.45
KDR P35968 1/20 0.44
JAK1 P23458 1/20 0.44
ABCG2 Q9UNQ0 1/20 0.44

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
SCHEMBL7258541 0.89 SYK (0.58) SYKULK1ULK2EGFRAURKA
SCHEMBL15584970 0.87 ULK1 (0.51) SYKULK1ULK2EGFRAURKA
SCHEMBL19654464 0.79 ULK1 (0.72) SYKULK1ULK2EGFR
SCHEMBL657592 0.78 SYK (0.76) SYKAURKA
SCHEMBL19675899 0.77 GRM4 (0.50) SYKULK1ULK2EGFRTGFBR1
SCHEMBL15585219 0.77 ULK1 (0.42) SYKULK1ULK2EGFRAURKA
SCHEMBL4002573 0.75 SYK (0.62) SYKULK1ULK2EGFRAURKA
SCHEMBL12749854 0.74 SYK (0.63) SYKEGFRAURKABTKJAK3
SCHEMBL28504428 0.74 JAK3 (0.58) SYKEGFRAURKABTKJAK3
SCHEMBL4000667 0.74 JAK3 (0.61) SYKEGFRAURKABTKJAK3

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
EP-2840080-B1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUND OR SALT THEREOF FUJIFILM CORP (JP) 2017-12-06 EP disclosed