SCHEMBL5866690

SCHEMBL5866690

[CH2]C1CN(c2ccc3nc(-c4n[nH]c5c(OC(C)C)cccc45)[nH]c3c2)C(C)CO1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 15/20 0.40
FLT1 P17948 5/20 0.40
KDR P35968 4/20 0.39
ABL1 P00519 4/20 0.37
PDGFRA P16234 1/20 0.35
FGFR2 P21802 1/20 0.35
FGFR4 P22455 1/20 0.35
FGFR3 P22607 1/20 0.35
CDK4 P11802 1/20 0.34
CCNA2 P20248 1/20 0.34
CCND1 P24385 1/20 0.34
CDK2 P24941 1/20 0.34
CCND3 P30281 1/20 0.34
PDPK1 O15530 1/20 0.34

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
SCHEMBL5866910 0.91 FGFR1 (0.42) FGFR1FLT1KDRABL1FGFR2
SCHEMBL5866718 0.86 ABL1 (0.47) FGFR1FLT1ABL1CDK4CCNA2
SCHEMBL5866777 0.84 FGFR1 (0.46) FGFR1FLT1KDRABL1PDGFRA
SCHEMBL5866685 0.81 FGFR1 (0.44) FGFR1FLT1KDRABL1FGFR2
SCHEMBL5866803 0.78 ABL1 (0.49) FGFR1FLT1KDRABL1FGFR2
SCHEMBL3539243 0.78 FGFR1 (0.67) FGFR1FLT1KDRABL1PDGFRA
SCHEMBL3542676 0.77 FGFR1 (0.48) FGFR1FLT1KDRABL1FGFR3
SCHEMBL5866701 0.76 FGFR1 (0.60) FGFR1FLT1ABL1PDPK1
SCHEMBL3538199 0.76 FGFR1 (0.42) FGFR1FLT1KDRABL1PDPK1
SCHEMBL3535802 0.76 FGFR1 (0.37) FGFR1FLT1KDRABL1PDPK1

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