SCHEMBL17833280

SCHEMBL17833280

CNCCCNc1nc(-c2cc(Cl)cc(C(F)(F)F)c2)nc2c(C)cccc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 2/20 0.37
CTNNB1 P35222 2/20 0.36
TCF7L2 Q9NQB0 2/20 0.36
KMT2A Q03164 4/20 0.36
MEN1 O00255 2/20 0.36
POLB P06746 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
SLC2A1 P11166 1/20 0.35
KDM4E B2RXH2 2/20 0.35
ALDH1A1 P00352 1/20 0.35
GAA P10253 1/20 0.35
RAD52 P43351 1/20 0.35
CTSK P43235 1/20 0.35
KCNH2 Q12809 1/20 0.35
ACP1 P24666 1/20 0.34
TNKS O95271 1/20 0.34
TNKS2 Q9H2K2 1/20 0.34
PARP2 Q9UGN5 1/20 0.34
MAPT P10636 2/20 0.34
USP1 O94782 1/20 0.33

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
SCHEMBL17833283 0.93 SYK (0.40) SYKCTNNB1TCF7L2KMT2AMEN1
SCHEMBL17833161 0.91 KMT2A (0.40) SYKCTNNB1TCF7L2KMT2AMEN1
SCHEMBL17829869 0.89 POLB (0.50) KMT2APOLBSLC2A1ALDH1A1RAD52
SCHEMBL17833279 0.89 CTNNB1 (0.37) SYKCTNNB1TCF7L2KMT2AKDM4E
SCHEMBL17833235 0.89 SYK (0.43) SYKCTNNB1TCF7L2KMT2AKDM4E
SCHEMBL17833238 0.89 TNKS (0.41) SYKCTNNB1TCF7L2KMT2AKDM4E
SCHEMBL17829964 0.88 CYP1A2 (0.37) SYKKMT2AMEN1POLBSMN1; SMN2
SCHEMBL17829910 0.86 SYK (0.44) SYKKMT2AMEN1POLBKDM4E
SCHEMBL17833150 0.85 CYP1A2 (0.41) KMT2AMEN1ALDH1A1USP1WDR48
SCHEMBL17833277 0.84 SYK (0.37) SYKCTNNB1TCF7L2KMT2AMEN1

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
WO-2016094730-A1 HETEROCYCLIC COMPOUNDS AS ANTIBIOTIC POTENTIATORS SYNERECA PHARMACEUTICALS, INC. (US) 2016-06-16 WO disclosed