SCHEMBL5866718

SCHEMBL5866718

[CH2]C1CN(c2ccc3nc(-c4n[nH]c5c(OCc6ccccc6)cccc45)[nH]c3c2)C(C)CO1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 8/20 0.47
FGFR1 P11362 13/20 0.47
FLT1 P17948 10/20 0.47
BCR P11274 2/20 0.43
USP30 Q70CQ3 1/20 0.36
ITK Q08881 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

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
SCHEMBL5866701 0.89 FGFR1 (0.60) ABL1FGFR1FLT1BCRUSP30
SCHEMBL5866910 0.89 FGFR1 (0.42) ABL1FGFR1FLT1ITKCDK4
SCHEMBL5866690 0.86 FGFR1 (0.40) ABL1FGFR1FLT1CDK4CCNA2
SCHEMBL5866660 0.86 FGFR1 (0.60) ABL1FGFR1FLT1BCRCDK4
SCHEMBL3537724 0.79 FGFR1 (0.65) ABL1FGFR1FLT1BCRCDK4
SCHEMBL5866685 0.78 FGFR1 (0.44) ABL1FGFR1FLT1CDK4CCNA2
SCHEMBL3538556 0.78 ABL1 (0.39) ABL1FGFR1FLT1BCRITK
SCHEMBL3595759 0.76 FGFR1 (0.38) ABL1FGFR1FLT1BCR
SCHEMBL3542676 0.76 FGFR1 (0.48) ABL1FGFR1FLT1ITKCDK2
SCHEMBL5866803 0.76 ABL1 (0.49) ABL1FGFR1FLT1CDK4CCNA2

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