SCHEMBL23967926

SCHEMBL23967926

CNc1cccc(-c2ccnc3[nH]c4ccccc4c23)c1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTK6 Q13882 10/20 0.49
ALK Q9UM73 5/20 0.49
ERBB2 P04626 4/20 0.49
AURKA O14965 2/20 0.49
EGFR P00533 1/20 0.49
SRC P12931 1/20 0.49
ACVR1 Q04771 1/20 0.49
AURKC Q9UQB9 1/20 0.49
MAPK14 Q16539 1/20 0.46
BRD4 O60885 1/20 0.44
UTS2R Q9UKP6 1/20 0.42

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
SCHEMBL17471213 0.87 PTK6 (0.49) PTK6ALKERBB2AURKAEGFR
SCHEMBL16257469 0.84 LRRK2 (0.53) PTK6ALKERBB2AURKAEGFR
SCHEMBL16024050 0.82 MAPK14 (0.45) PTK6ALKERBB2AURKAEGFR
SCHEMBL16011996 0.82 PTK6 (0.47) PTK6ALKERBB2AURKAEGFR
SCHEMBL17453379 0.81 UTS2R (0.44) PTK6ALKERBB2AURKAEGFR
SCHEMBL16024047 0.81 ERBB2 (0.61) PTK6ALKERBB2AURKAEGFR
SCHEMBL16011993 0.81 MAPK14 (0.48) PTK6ALKERBB2AURKAEGFR
SCHEMBL23967953 0.81 PRMT6 (0.48) PTK6ALKERBB2AURKAEGFR
SCHEMBL16024064 0.80 UTS2R (0.47) PTK6ALKERBB2AURKAEGFR
SCHEMBL16024043 0.79 CYP17A1 (0.49) PTK6ALKERBB2AURKAEGFR

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-3189052-B1 CAMKII INHIBITORS AND USES THEREOF UNIV JOHNS HOPKINS (US) 2021-11-03 EP disclosed