SCHEMBL19817005

SCHEMBL19817005

COc1cccc(Br)c1-c1cc2cnc(SC)nc2nc1Cl

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 5/20 0.39
AURKA O14965 1/20 0.36
KDR P35968 1/20 0.36
AURKB Q96GD4 1/20 0.36
MAPT P10636 2/20 0.35
ALDH1A1 P00352 1/20 0.35
PLA2G1B P04054 1/20 0.35
POLB P06746 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
ATG4B Q9Y4P1 1/20 0.35
TP53 P04637 1/20 0.34
SRC P12931 3/20 0.34
PDGFRB P09619 2/20 0.34
PDGFRA P16234 2/20 0.34
HSP90AA1 P07900 1/20 0.33
HSP90AB1 P08238 1/20 0.33
AKT1 P31749 3/20 0.33
AKT2 P31751 3/20 0.33
WEE1 P30291 1/20 0.33
ALPL P05186 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
SCHEMBL19816952 0.87 FGFR1 (0.56) FGFR1AURKAKDRAURKBSRC
SCHEMBL21761868 0.81 FGFR4 (0.36) FGFR1AURKAKDRAURKBMAPT
SCHEMBL19817044 0.80 FGFR1 (0.50) FGFR1AURKAKDRAURKBSRC
SCHEMBL29536557 0.80 FGFR1 (0.50) FGFR1AURKAKDRAURKBSRC
SCHEMBL19816981 0.75 FGFR1 (0.37) FGFR1MAPTALDH1A1PLA2G1BPOLB
SCHEMBL23328706 0.75 FGFR1 (0.50) FGFR1AURKAKDRAURKBMAPT
SCHEMBL21783951 0.74 MEN1 (0.36) FGFR1KDR
SCHEMBL6073377 0.73 MEN1 (0.38) MAPTALDH1A1AKT1AKT2
SCHEMBL29537852 0.73 MEN1 (0.38) MAPTALDH1A1AKT1AKT2
SCHEMBL2893422 0.73 AKT1 (0.48) AKT1AKT2

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-2018023081-A1 6-PHENYLPYRIDO[2,3-D]PYRIMIDINE COMPOUNDS AS ANTIBACTERIAL AGENTS ACHAOGEN, INC. (US) 2018-02-01 WO disclosed