SCHEMBL7728583

SCHEMBL7728583

CCC(CC)(c1ccc(NC=C2C(=O)Nc3ncc(-c4ccccc4)cc32)cc1)P(=O)(O)O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 1/20 0.36
MAP3K11 Q16584 2/20 0.34
NTRK1 P04629 3/20 0.32
MET P08581 2/20 0.32
CHEK1 O14757 1/20 0.32
AURKA O14965 1/20 0.32
DAPK3 O43293 1/20 0.32
PRKD3 O94806 1/20 0.32
MAP4K4 O95819 1/20 0.32
ABL1 P00519 1/20 0.32
CSF1R P07333 1/20 0.32
RET P07949 1/20 0.32
PDGFRB P09619 1/20 0.32
PIM1 P11309 1/20 0.32
FGFR1 P11362 1/20 0.32
PDGFRA P16234 1/20 0.32
FLT1 P17948 1/20 0.32
LTK P29376 1/20 0.32
GRK5 P34947 1/20 0.32
KDR P35968 1/20 0.32

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
SCHEMBL7726572 0.87 AXL (0.32) JAK3MAP3K11RET
SCHEMBL5873793 0.82 JAK3 (0.39) JAK3MAP3K11NTRK1METCHEK1
SCHEMBL5873796 0.82 JAK3 (0.39) JAK3MAP3K11NTRK1METCHEK1
SCHEMBL6872584 0.79 CDK9 (0.40) JAK3MAP3K11NTRK1METCHEK1
SCHEMBL6872582 0.79 CDK9 (0.40) JAK3MAP3K11NTRK1METCHEK1
SCHEMBL5873916 0.79 JAK3 (0.43) JAK3MAP3K11NTRK1METCHEK1
SCHEMBL5873915 0.79 JAK3 (0.43) JAK3MAP3K11NTRK1METCHEK1
SCHEMBL5873862 0.78 JAK3 (0.36) JAK3MAP3K11NTRK1METCHEK1
SCHEMBL5430358 0.75 ALDH1A1 (0.46) JAK3MAP3K11NTRK1METCHEK1
SCHEMBL5430362 0.75 ALDH1A1 (0.46) JAK3MAP3K11NTRK1METCHEK1

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
EP-1165514-A1 3-(ANILINOMETHYLENE) OXINDOLES AS PROTEIN TYROSINE KINASE AND PROTEIN SERINE/THREONINE KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2002-01-02 EP claimed
WO-2000056710-A1 3-(ANILINOMETHYLENE) OXINDOLES AS PROTEIN TYROSINE KINASE AND PROTEIN SERINE/THREONINE KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2000-09-28 WO claimed