SCHEMBL3383453

SCHEMBL3383453

CC(C)(C)c1nnc(NC(=O)Cc2ccc(-c3cnc4cc(-c5ccc(S(C)(=O)=O)cc5)ccn34)cc2)s1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 7/20 0.53
ALDH1A1 P00352 2/20 0.52
GLS O94925 1/20 0.46
KDR P35968 4/20 0.45
NTRK1 P04629 1/20 0.45
CSF1R P07333 1/20 0.45
RET P07949 1/20 0.45
KCNH2 Q12809 1/20 0.45
CCDC6 Q16204 1/20 0.45
WNT3A P56704 1/20 0.43
HDAC1 Q13547 2/20 0.42
HDAC2 Q92769 2/20 0.42
PAX8 Q06710 1/20 0.41

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
SCHEMBL3385521 0.89 ALDH1A1 (0.55) FLT3ALDH1A1KDRWNT3A
SCHEMBL3385825 0.89 FLT3 (0.51) FLT3ALDH1A1KDR
SCHEMBL3386448 0.87 FLT3 (0.54) FLT3ALDH1A1KDR
SCHEMBL3386105 0.85 ALDH1A1 (0.52) FLT3ALDH1A1KDR
SCHEMBL3386505 0.82 RET (0.65) FLT3KDRNTRK1CSF1RRET
SCHEMBL3383213 0.78 RET (0.55) FLT3KDRRET
SCHEMBL3385413 0.78 RORC (0.48) FLT3KDRNTRK1CSF1RRET
SCHEMBL3384408 0.78 KDR (0.50) FLT3KDR
SCHEMBL3385250 0.77 FLT3 (0.47) FLT3KDRNTRK1CSF1RRET
SCHEMBL3386064 0.77 FLT3 (0.51) FLT3KDR

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
EP-1904494-B1 IMIDAZO[1,2-A]PYRIDINE COMPOUNDS AS VEGF-R2 INHIBITORS LILLY CO ELI (US) 2010-12-01 EP disclosed