SCHEMBL12473996

SCHEMBL12473996

CSCCCNC(=O)c1ccc2c(c1)NC(=O)C2=Cc1[nH]c(C)cc1C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDGFRA P16234 3/20 1.00
▸ KDR P35968 5/20 0.86
▸ PDGFRB P09619 4/20 0.86
▸ TLK2 Q86UE8 1/20 0.53
▸ AURKB Q96GD4 2/20 0.52
▸ RET P07949 8/20 0.51
▸ FLT3 P36888 3/20 0.51
▸ ALK Q9UM73 3/20 0.51
▸ CSF1R P07333 3/20 0.51
▸ FGFR1 P11362 2/20 0.51
▸ SRC P12931 2/20 0.51
▸ FLT1 P17948 2/20 0.51
▸ FGFR3 P22607 2/20 0.51
▸ MAPK1 P28482 2/20 0.51
▸ FLT4 P35916 2/20 0.51
▸ PDPK1 O15530 2/20 0.51
▸ MEN1 O00255 1/20 0.51
▸ NPC1 O15118 1/20 0.51
▸ GMNN O75496 1/20 0.51
▸ USP2 O75604 1/20 0.51

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
SCHEMBL12473994 1.00 PDGFRA (1.00) PDGFRAKDRPDGFRBTLK2AURKB
SCHEMBL12474005 0.93 KDR (1.00) PDGFRAKDRPDGFRBTLK2AURKB
SCHEMBL12474001 0.93 KDR (1.00) PDGFRAKDRPDGFRBTLK2AURKB
SCHEMBL30685892 0.83 PDGFRA (0.71) PDGFRAKDRPDGFRBTLK2AURKB
SCHEMBL30685852 0.79 PDGFRB (0.68) PDGFRAKDRPDGFRBTLK2AURKB
SCHEMBL30685915 0.75 KDR (0.70) PDGFRAKDRPDGFRBTLK2AURKB
SCHEMBL26261 0.75 KDR (0.59) PDGFRAKDRPDGFRBTLK2AURKB
SCHEMBL30685791 0.75 PAK4 (0.87) PDGFRAKDRPDGFRBTLK2AURKB
SCHEMBL5368286 0.74 PAK4 (0.69) PDGFRAKDRPDGFRBTLK2AURKB
SCHEMBL30685781 0.73 PDGFRA (0.58) PDGFRAKDRPDGFRBTLK2AURKB

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
WO-2012025726-A1 Novel Hybrid Compounds UNIVERSITY OF GREENWICH (GB) 2012-03-01 — — WO claimed
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