SCHEMBL5873812

SCHEMBL5873812

O=C1Nc2ncc(-c3ccco3)cc2C1=CNc1ccc(CP(=O)(O)O)cc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RET P07949 1/20 0.34
TLK2 Q86UE8 2/20 0.33
JAK3 P52333 1/20 0.33
AXL P30530 1/20 0.32
TDP2 O95551 2/20 0.32
MAPT P10636 3/20 0.31
HSD17B10 Q99714 3/20 0.31
ALDH1A1 P00352 2/20 0.31
KDM4E B2RXH2 2/20 0.31
CCNT1 O60563 1/20 0.31
CDK9 P50750 1/20 0.31
LMNA P02545 1/20 0.31
HPGD P15428 1/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
AKT1 P31749 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MAP3K11 Q16584 2/20 0.31
NPC1 O15118 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL5873800 1.00 RET (0.34) RETTLK2JAK3AXLTDP2
SCHEMBL5873883 0.87 CCNT1 (0.35) RETJAK3AXLCCNT1CDK9
SCHEMBL5873886 0.87 CCNT1 (0.35) RETJAK3AXLCCNT1CDK9
SCHEMBL5873793 0.86 JAK3 (0.39) RETJAK3CCNT1CDK9MAP3K11
SCHEMBL5873796 0.86 JAK3 (0.39) RETJAK3CCNT1CDK9MAP3K11
SCHEMBL5873779 0.84 RET (0.37) RETTLK2JAK3AXLTDP2
SCHEMBL5873783 0.84 RET (0.37) RETTLK2JAK3AXLTDP2
SCHEMBL7726572 0.84 AXL (0.32) RETJAK3AXLMAP3K11CNR1
SCHEMBL5873876 0.82 FLT1 (0.35) RETTLK2JAK3AXLTDP2
SCHEMBL5873874 0.82 FLT1 (0.35) RETTLK2JAK3AXLTDP2

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-7129253-B2 Compounds SMITHKLINE BEECHAM CORPORATION (US) 2006-10-31 US disclosed
US-6818632-B2 3-(anilinomethylene)oxindoles SMITHKLINE BEECHAM CORPORATION 2004-11-16 US disclosed