SCHEMBL7134752

SCHEMBL7134752

Cc1c(Br)cc(Br)c2c1C(=Cc1ccccc1O)C(=O)N2

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLK4 O00444 1/20 0.48
PLK1 P53350 1/20 0.48
NAT1 P18440 2/20 0.40
KMT2A Q03164 5/20 0.39
MEN1 O00255 4/20 0.39
RAF1 P04049 1/20 0.36
ALDH1A1 P00352 2/20 0.36
MCL1 Q07820 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
MAPT P10636 1/20 0.35
XBP1 P17861 1/20 0.35
MAPK1 P28482 1/20 0.35
NTSR1 P30989 1/20 0.35
MAP3K7 O43318 1/20 0.34
TAB1 Q15750 1/20 0.34
XDH P47989 1/20 0.34
SIRT1 Q96EB6 2/20 0.34
GSK3B P49841 1/20 0.34

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
SCHEMBL7135224 0.90 MAP3K7 (0.38) PLK4PLK1KMT2AMEN1RAF1
SCHEMBL7138169 0.88 POLB (0.42) KMT2AMEN1RAF1ALDH1A1NPSR1
SCHEMBL7139425 0.87 KMT2A (0.49) NAT1KMT2AMEN1ALDH1A1MAPT
SCHEMBL7132313 0.86 GAA (0.45) KMT2AMEN1MCL1TDP1MAPT
SCHEMBL7132942 0.86 PTP4A3 (0.45) PLK4KMT2AMEN1MAPTSIRT1
SCHEMBL7138173 0.86 TDP1 (0.39) PLK4PLK1KMT2AMEN1ALDH1A1
SCHEMBL7138946 0.85 NPC1 (0.48) KMT2AMEN1RAF1ALDH1A1MCL1
SCHEMBL7134889 0.85 DYRK1A (0.39) KMT2AMEN1ALDH1A1TDP1MAPT
SCHEMBL7138047 0.84 LRRK2 (0.43) KMT2AMEN1ALDH1A1MAPTSIRT1
SCHEMBL7139752 0.84 MAP3K7 (0.39) PLK4PLK1KMT2AMEN1RAF1

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