SCHEMBL23749458

SCHEMBL23749458

CCOc1ccn(-c2ccc(F)cc2)c(=O)c1C(=O)Nc1ccc(Oc2ccnc3cc(OCCCC#N)c4c(c23)OCCO4)cc1Cl

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MST1R Q04912 5/20 0.56
KDR P35968 5/20 0.53
RET P07949 8/20 0.52
MET P08581 4/20 0.48
AXL P30530 5/20 0.47
TYRO3 Q06418 3/20 0.47
MERTK Q12866 3/20 0.47
PLK4 O00444 1/20 0.47
ABL1 P00519 1/20 0.47
NTRK1 P04629 1/20 0.47
LCK P06239 1/20 0.47
KIT P10721 1/20 0.47
PDGFRA P16234 1/20 0.47
PRKACA P17612 1/20 0.47
FLT3 P36888 1/20 0.47
ABL2 P42684 1/20 0.47
FRK P42685 1/20 0.47
DDR1 Q08345 1/20 0.47
PDE4D Q08499 1/20 0.47
MAP4K2 Q12851 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
SCHEMBL23749429 0.95 RET (0.54) MST1RKDRRETMETAXL
SCHEMBL23749289 0.93 MST1R (0.62) MST1RKDRRETMETAXL
SCHEMBL24178990 0.91 MST1R (0.56) MST1RKDRRETMETAXL
SCHEMBL23749329 0.90 MST1R (0.60) MST1RKDRRETMETAXL
SCHEMBL23749575 0.90 MST1R (0.58) MST1RKDRRETMETAXL
SCHEMBL23771066 0.90 MST1R (0.55) MST1RKDRRETMETAXL
SCHEMBL24179169 0.90 MST1R (0.55) MST1RKDRRETMETAXL
SCHEMBL23749398 0.90 KDR (0.60) MST1RKDRRETMETAXL
SCHEMBL23749423 0.90 KDR (0.67) MST1RKDRRETMETAXL
SCHEMBL23749474 0.89 MST1R (0.59) MST1RKDRRETMETAXL

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-3865487-A1 AROMATIC RING-LINKED DIOXANE-QUINAZOLINE OR -QUINOLINE COMPOUNDS, COMPOSITIONS AND USE THEREOF Beijing Scitech-MQ Pharmaceuticals Limited (CN) 2021-08-18 EP disclosed