SCHEMBL73262

SCHEMBL73262

c1cc(Nc2nncs2)cc(-c2cnc3ccccn23)c1

nearest known ligand 0.53

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FGFR3 P22607 6/20 0.53
KDR P35968 5/20 0.53
PKM P14618 7/20 0.53
CDK2 P24941 2/20 0.48
CDK1 P06493 1/20 0.48
CDK4 P11802 1/20 0.48
MIF P14174 1/20 0.46
IRAK4 Q9NWZ3 1/20 0.46
FLT3 P36888 2/20 0.43
PIK3CA P42336 1/20 0.40

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
SCHEMBL13407665 0.88 KDR (0.61) FGFR3KDRFLT3
SCHEMBL3581751 0.86 FGFR3 (0.61) FGFR3KDRPKMCDK2FLT3
SCHEMBL3590921 0.86 FGFR3 (0.56) FGFR3KDRCDK2FLT3
Hydrochloric Acid SCHEMBL17157044 0.85 FGFR3 (0.55) FGFR3KDRCDK2FLT3
SCHEMBL13407683 0.83 FGFR3 (0.60) FGFR3KDR
SCHEMBL73095 0.83 PKM (0.53) FGFR3KDRPKMCDK2CDK1
SCHEMBL563607 0.82 FGFR3 (0.62) FGFR3KDR
SCHEMBL3590287 0.82 KDR (0.63) FGFR3KDRFLT3
Hydrochloric Acid SCHEMBL17157041 0.82 FGFR3 (0.59) FGFR3KDR
SCHEMBL2911187 0.82 FGFR3 (0.59) FGFR3KDRPKM

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8131527-B1 FGFR pharmacophore compounds ASTEX THERAPEUTICS LTD. (GB) 2012-03-06 US disclosed
US-8131527-B1 FGFR pharmacophore compounds ASTEX THERAPEUTICS LTD. (GB) 2012-03-06 US disclosed