SCHEMBL5866728

SCHEMBL5866728

COc1ccc2[nH]nc(-c3nc4ccc(N5C[C@H](CN(C)C(C)C)OC[C@@H]5C)cc4[nH]3)c2c1

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 5/20 0.51
FGFR1 P11362 16/20 0.46
KDR P35968 3/20 0.46
PDGFRA P16234 1/20 0.42
FGFR2 P21802 1/20 0.42
FGFR4 P22455 1/20 0.42
FGFR3 P22607 1/20 0.42
FLT1 P17948 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
SCHEMBL5866809 1.00 ABL1 (0.51) ABL1FGFR1KDRPDGFRAFGFR2
SCHEMBL5866631 1.00 ABL1 (0.51) ABL1FGFR1KDRPDGFRAFGFR2
SCHEMBL5866643 1.00 ABL1 (0.51) ABL1FGFR1KDRPDGFRAFGFR2
SCHEMBL5866636 1.00 ABL1 (0.51) ABL1FGFR1KDRPDGFRAFGFR2
SCHEMBL6582455 0.93 ABL1 (0.53) ABL1FGFR1KDRFLT1
SCHEMBL3539306 0.90 ABL1 (0.52) ABL1FGFR1KDRFLT1
SCHEMBL3533004 0.90 ABL1 (0.52) ABL1FGFR1KDRFLT1
SCHEMBL3534766 0.90 ABL1 (0.52) ABL1FGFR1KDRFLT1
SCHEMBL3533006 0.90 ABL1 (0.52) ABL1FGFR1KDRFLT1
SCHEMBL3541753 0.90 ABL1 (0.52) ABL1FGFR1KDRFLT1

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
US-7064215-B2 Indazole benzimidazole compounds CHIRON CORPORATION (US) 2006-06-20 US disclosed