SCHEMBL7138258

SCHEMBL7138258

CNS(=O)(=O)c1ccc2c(c1)C(=Cc1ccccc1C)C(=O)N2

nearest known ligand 0.66

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.66
KMT2A Q03164 2/20 0.66
KDR P35968 7/20 0.57
CDK2 P24941 2/20 0.57
SRC P12931 10/20 0.56
SYK P43405 4/20 0.56
NTRK1 P04629 3/20 0.56
FCER2 P06734 2/20 0.56
NTRK3 Q16288 2/20 0.56
NTRK2 Q16620 2/20 0.56
LCK P06239 6/20 0.51
FYN P06241 6/20 0.51
YES1 P07947 6/20 0.51
FGFR1 P11362 6/20 0.51
PDGFRB P09619 5/20 0.51
FLT3 P36888 2/20 0.48

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
SCHEMBL7132020 0.87 MEN1 (0.58) MEN1KMT2AKDRCDK2SRC
SCHEMBL7133821 0.87 KDR (0.56) MEN1KMT2AKDRCDK2SRC
SCHEMBL7132924 0.87 NPC1 (0.60) MEN1KMT2AKDRCDK2SRC
SCHEMBL7130537 0.87 MEN1 (0.58) MEN1KMT2AKDRCDK2SRC
SCHEMBL7131130 0.85 NPC1 (0.63) MEN1KMT2AKDRCDK2SRC
SCHEMBL7137643 0.84 KDR (0.54) MEN1KMT2AKDRCDK2SRC
SCHEMBL7136896 0.84 KDR (0.56) MEN1KMT2AKDRCDK2SRC
SCHEMBL5369843 0.84 SRC (0.59) KDRCDK2SRCSYKNTRK1
SCHEMBL5362316 0.83 SYK (0.60) KDRCDK2SRCSYKNTRK1
SCHEMBL7140007 0.83 KDR (0.55) MEN1KMT2AKDRCDK2SRC

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
US-6506763-B2 Useful in prevention and treatment of protein kinase related disorders such as cancer SUGEN, INC. 2003-01-14 US disclosed