SCHEMBL24590999

SCHEMBL24590999

Nc1ncc(-c2cnn(CC(F)(F)F)c2)nc1NCc1ccn2nccc2n1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MET P08581 4/20 0.44
CSF1R P07333 1/20 0.43
TYRO3 Q06418 1/20 0.37
ATR Q13535 1/20 0.35
PIK3CD O00329 2/20 0.34
PIK3CB P42338 2/20 0.34
MTOR P42345 2/20 0.34
PIK3CG P48736 2/20 0.34
ALOX5AP P20292 1/20 0.34
LDHA P00338 1/20 0.34
LDHB P07195 1/20 0.34
PIM1 P11309 4/20 0.34
PIM3 Q86V86 3/20 0.34
PIM2 Q9P1W9 3/20 0.34
IKBKE Q14164 1/20 0.33
TBK1 Q9UHD2 1/20 0.33
PDE10A Q9Y233 1/20 0.33
DYRK1A Q13627 1/20 0.33
SCN5A Q14524 1/20 0.32

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
SCHEMBL21167444 0.86 CSF1R (0.46) METCSF1RTYRO3LDHALDHB
SCHEMBL21167604 0.84 CSF1R (0.62) METCSF1RLDHALDHB
SCHEMBL21167754 0.84 MET (0.60) METCSF1RTYRO3ATRPIK3CD
SCHEMBL21167393 0.83 MET (0.44) METCSF1RTYRO3PIK3CDPIK3CB
SCHEMBL21167601 0.78 CSF1R (0.40) METCSF1RPIK3CDPIK3CBPIK3CG
SCHEMBL24590986 0.78 MET (0.59) METCSF1RTYRO3PIK3CDPIK3CB
SCHEMBL21167443 0.76 MET (0.42) METCSF1RPDE10A
SCHEMBL24591017 0.74 MET (0.43) METCSF1RPDE10A
SCHEMBL22475943 0.74 MET (0.59) METCSF1RTYRO3PIM1PIM3
SCHEMBL12689739 0.74 MET (0.73) METPDE10A

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-3795573-B1 CERTAIN TRIAZOLOPYRAZINES, COMPOSITIONS THEREOF AND METHODS OF USE THEREFOR HUTCHISON MEDIPHARMA LTD (CN) 2022-07-06 EP disclosed