SCHEMBL7138232

SCHEMBL7138232

Cc1c(Br)cc(Br)c2c1C(=Cc1c[nH]c3ccccc13)C(=O)N2

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 5/20 0.52
RET P07949 3/20 0.52
PRKD3 O94806 2/20 0.52
ABL1 P00519 2/20 0.52
PDGFRB P09619 2/20 0.52
LTK P29376 2/20 0.52
KDR P35968 2/20 0.52
FLT3 P36888 2/20 0.52
CSNK1A1 P48729 2/20 0.52
CDK7 P50613 2/20 0.52
MAP2K1 Q02750 2/20 0.52
MST1R Q04912 2/20 0.52
NTRK3 Q16288 2/20 0.52
NTRK2 Q16620 2/20 0.52
AURKB Q96GD4 2/20 0.52
CLK4 Q9HAZ1 2/20 0.52
ALK Q9UM73 2/20 0.52
DAPK3 O43293 1/20 0.52
MAP4K4 O95819 1/20 0.52
LCK P06239 1/20 0.52

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
SCHEMBL7132142 0.84 NTRK1 (0.58) NTRK1RETPRKD3ABL1PDGFRB
SCHEMBL7138169 0.82 POLB (0.42) RETKDRFLT3MAPTALDH1A1
SCHEMBL7139425 0.81 KMT2A (0.49) RETKDRFLT3MAPTKDM4E
SCHEMBL7139112 0.80 PIK3CA (0.41) KDRCDK7AURKBCDK5MAPT
SCHEMBL7134889 0.79 DYRK1A (0.39) KDRMAPTALDH1A1MEN1KMT2A
SCHEMBL7134752 0.79 PLK4 (0.48) PDGFRBCSF1RMAPTALDH1A1MEN1
SCHEMBL7138946 0.79 NPC1 (0.48) KDRFLT3MAP2K1MAPTKDM4E
SCHEMBL7136101 0.78 RET (0.44) RETLRRK2HPGDNPC1RAB9A
SCHEMBL7139579 0.78 RET (0.38) NTRK1RETPRKD3KDRFLT3
SCHEMBL7133179 0.78 KMT2A (0.60) NTRK1RETPRKD3KDRCSNK1A1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6506763-B2 Useful in prevention and treatment of protein kinase related disorders such as cancer SUGEN, INC. 2003-01-14 US disclosed
EP-0984930-A1 2-INDOLINONE DERIVATIVES AS MODULATORS OF PROTEIN KINASE ACTIVITY Sugen, Inc. (US) 2000-03-15 EP disclosed
WO-1998050356-A1 2-INDOLINONE DERIVATIVES AS MODULATORS OF PROTEIN KINASE ACTIVITY SUGEN, INC. (US) 1998-11-12 WO disclosed