SCHEMBL6312944

SCHEMBL6312944

O=S(=O)(c1cccc(Nc2nccc(Nc3cnc4ccccc4c3)n2)c1)C(F)(F)F

nearest known ligand 0.67

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 11/20 0.67
EGFR P00533 3/20 0.53
INSR P06213 2/20 0.53
MET P08581 2/20 0.53
CDK2 P24941 2/20 0.53
KDR P35968 2/20 0.53
TEK Q02763 2/20 0.53
AURKA O14965 3/20 0.50
TNNI3K Q59H18 1/20 0.50
EPHB4 P54760 2/20 0.47
SYK P43405 1/20 0.45

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
SCHEMBL6319818 0.78 IGF1R (0.67) IGF1REGFRINSRMETCDK2
SCHEMBL6318996 0.78 IGF1R (0.67) IGF1REGFRINSRMETCDK2
SCHEMBL6312556 0.76 IGF1R (0.69) IGF1REGFRINSRMETCDK2
SCHEMBL30023065 0.76 SYK (0.49) CDK2AURKATNNI3KSYK
SCHEMBL6320480 0.76 IGF1R (0.69) IGF1REGFRINSRMETCDK2
SCHEMBL6642791 0.76 IGF1R (0.71) IGF1REGFRINSRMETCDK2
SCHEMBL6319730 0.76 IGF1R (0.71) IGF1REGFRINSRMETCDK2
SCHEMBL14634689 0.75 TNNI3K (0.52) AURKATNNI3KEPHB4SYK
SCHEMBL6311161 0.75 IGF1R (0.66) IGF1REGFRINSRMETCDK2
SCHEMBL6641667 0.73 JAK3 (0.65) IGF1RKDRAURKATNNI3KEPHB4

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-6939874-B2 Substituted pyrimidinyl derivatives and methods of use AMGEN INC. (US) 2005-09-06 US disclosed