SCHEMBL14304875

SCHEMBL14304875

Cc1ccc(NC(=O)c2cccc(CF)c2)cc1C(=O)Nc1cnc(Nc2ccc(S(=O)(=O)NCCN3CCCC3)cc2)nc1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ LCK P06239 14/20 0.54
▸ MAPK14 Q16539 6/20 0.54
▸ KDR P35968 3/20 0.54
▸ TEK Q02763 2/20 0.54
▸ SRC P12931 2/20 0.54
▸ ABL1 P00519 1/20 0.54
▸ FYN P06241 1/20 0.54
▸ CSF1R P07333 1/20 0.54
▸ LYN P07948 1/20 0.54
▸ MAPK9 P45984 1/20 0.54
▸ BTK Q06187 11/20 0.53
▸ BLK P51451 2/20 0.49
▸ JAK3 P52333 1/20 0.48
▸ KIT P10721 1/20 0.47

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
SCHEMBL14304882 0.86 LCK (0.55) LCKMAPK14KDRTEKSRC
SCHEMBL14304339 0.83 BTK (0.57) LCKMAPK14KDRTEKSRC
SCHEMBL2498334 0.81 BTK (0.61) LCKMAPK14KDRTEKSRC
SCHEMBL14303236 0.81 BTK (0.73) LCKMAPK14KDRBTKBLK
SCHEMBL5997067 0.81 SRC (0.55) SRCABL1
SCHEMBL2495019 0.79 LCK (0.70) LCKMAPK14KDRTEKSRC
SCHEMBL2498488 0.79 LCK (0.67) LCKMAPK14KDRTEKSRC
SCHEMBL14304879 0.78 LCK (0.51) LCKMAPK14KDRTEKSRC
SCHEMBL14303235 0.77 BTK (0.49) LCKMAPK14KDRTEKSRC
SCHEMBL12190169 0.76 LCK (0.68) LCKMAPK14KDRTEKSRC

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-2008008234-A1 2-AMINO-5-SUBSTITUTED PYRIMIDINE INHIBITORS TARGEGEN, INC. (US) 2008-01-17 — — WO disclosed
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