SCHEMBL3386402

SCHEMBL3386402

CC(C)(C)c1cc(NC(=O)Cc2ccc(B3OC(C)(C)C(C)(C)O3)cc2Cl)no1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 3/20 0.50
CNR1 P21554 3/20 0.45
CNR2 P34972 3/20 0.45
MAPT P10636 3/20 0.44
HTT P42858 3/20 0.44
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
RAB9A P51151 2/20 0.44
NPSR1 Q6W5P4 1/20 0.44
ATM Q13315 1/20 0.43
HPGD P15428 1/20 0.43
FLT3 P36888 1/20 0.43
MAPK14 Q16539 1/20 0.43
KDM4E B2RXH2 1/20 0.42
POLB P06746 1/20 0.42
RET P07949 2/20 0.40
ROCK1 Q13464 1/20 0.40
NPC1 O15118 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HIF1A Q16665 1/20 0.39

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
SCHEMBL16537813 0.88 ROCK1 (0.48) EGFRCNR1CNR2KMT2AMEN1
SCHEMBL1257268 0.84 FLT3 (0.54) EGFRRAB9AHPGDFLT3KDM4E
SCHEMBL31663638 0.80 KIT (0.53) EGFRCNR1CNR2FLT3RET
SCHEMBL16536471 0.80 KIT (0.53) EGFRCNR1CNR2FLT3RET
SCHEMBL3380690 0.78 RIOK2 (0.46) ROCK1HIF1A
SCHEMBL1258009 0.76 MAPK14 (0.65) KMT2AMEN1RAB9AFLT3MAPK14
SCHEMBL25249865 0.75 BTK (0.47) MAPTHPGDSMN1; SMN2HIF1A
SCHEMBL1256308 0.75 GAPDH (0.44) EGFRHPGDFLT3KDM4ERET
SCHEMBL27462607 0.74 BTK (0.41) MAPTKMT2AKDM4E
SCHEMBL5263766 0.74 ROCK1 (0.46) ROCK1HIF1A

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-1904494-B1 IMIDAZO[1,2-A]PYRIDINE COMPOUNDS AS VEGF-R2 INHIBITORS LILLY CO ELI (US) 2010-12-01 EP disclosed