SCHEMBL19978

SCHEMBL19978

Cc1cc(C)c(/C=C2\C(=O)Nc3ccc(N)cc32)[nH]1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RET P07949 10/20 1.00
ALK Q9UM73 8/20 1.00
FLT3 P36888 4/20 1.00
PDGFRB P09619 3/20 0.76
KDR P35968 4/20 0.73
PDPK1 O15530 2/20 0.73
CSF1R P07333 2/20 0.70
FGFR1 P11362 2/20 0.70
SRC P12931 2/20 0.70
FLT1 P17948 2/20 0.70
FGFR3 P22607 2/20 0.70
MAPK1 P28482 2/20 0.70
FLT4 P35916 2/20 0.70
ABL1 P00519 2/20 0.70
MEN1 O00255 1/20 0.70
NPC1 O15118 1/20 0.70
GMNN O75496 1/20 0.70
USP2 O75604 1/20 0.70
LMNA P02545 1/20 0.70
MAPT P10636 1/20 0.70

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
SCHEMBL19979 1.00 RET (1.00) RETALKFLT3PDGFRBKDR
SCHEMBL5475963 0.84 PDGFRB (0.81) RETALKFLT3PDGFRBKDR
SCHEMBL29394706 0.84 RET (1.00) RETALKFLT3PDGFRBKDR
SCHEMBL4416658 0.84 RET (1.00) RETALKFLT3PDGFRBKDR
SCHEMBL5478517 0.84 PDPK1 (1.00) RETALKFLT3PDGFRBKDR
SCHEMBL5475962 0.84 PDGFRB (0.81) RETALKFLT3PDGFRBKDR
SCHEMBL13081086 0.84 RET (1.00) RETALKFLT3PDGFRBKDR
SCHEMBL31726696 0.84 RET (0.76) RETALKFLT3PDGFRBKDR
SCHEMBL2126784 0.84 RET (1.00) RETALKFLT3PDGFRBKDR
SCHEMBL5203211 0.84 PDPK1 (1.00) RETALKFLT3PDGFRBKDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012025726-A1 Novel Hybrid Compounds UNIVERSITY OF GREENWICH (GB) 2012-03-01 WO disclosed
US-7202265-B2 Indolinone combinatorial libraries and related products and methods for the treatment of disease SUGEN, INC. (US) 2007-04-10 US disclosed
US-7202265-B2 Indolinone combinatorial libraries and related products and methods for the treatment of disease SUGEN, INC. (US) 2007-04-10 US disclosed