SCHEMBL20895703

SCHEMBL20895703

Cc1cn2nc(-c3ccn4c(I)cnc4c3)sc2n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR3 P22607 4/20 0.50
KDR P35968 4/20 0.50
TP53 P04637 1/20 0.37
FLT3 P36888 4/20 0.35
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
KDM4E B2RXH2 2/20 0.34
ALDH1A1 P00352 2/20 0.34
HSD17B10 Q99714 2/20 0.34
NPC1 O15118 1/20 0.34
POLB P06746 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
NEK2 P51955 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
HPGD P15428 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
SCHEMBL602086 0.76 FGFR3 (0.46) FGFR3KDRFLT3
SCHEMBL13337071 0.72 FLT3 (0.38) FGFR3KDRFLT3KDM4EALDH1A1
SCHEMBL3197111 0.71 KDR (0.43) KDRFLT3
SCHEMBL3177430 0.71 FLT3 (0.46) KDRFLT3
SCHEMBL1431511 0.70 KDR (0.45) FGFR3KDRFLT3
SCHEMBL1431367 0.69 KDR (0.46) FGFR3KDRFLT3
SCHEMBL601400 0.69 KDR (0.51) FGFR3KDRFLT3
SCHEMBL11925640 0.68 KDR (0.46) FGFR3KDRFLT3KDM4EALDH1A1
SCHEMBL532747 0.68 ALDH1A1 (0.64) KDM4EALDH1A1HSD17B10NPC1POLB
SCHEMBL532352 0.68 PIK3CA (0.41) TP53CA12CA1CA2CA9

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
EP-2300465-B1 IMIDAZOPYRIDINE DERIVATIVES AS INHIBITORS OF RECEPTOR TYROSINE KINASES ASTEX THERAPEUTICS LTD (GB) 2019-04-17 EP disclosed