SCHEMBL4008935

SCHEMBL4008935

O=S(=O)(Oc1ccc2[nH]nc(-c3cc4ccccc4[nH]3)c2c1)c1c(Cl)cccc1Cl

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FGFR1 P11362 1/20 0.56
▸ ITK Q08881 19/20 0.53
▸ PLK4 O00444 1/20 0.43
▸ CHEK1 O14757 1/20 0.43
▸ AURKA O14965 1/20 0.43
▸ CCNB2 O95067 1/20 0.43
▸ ABL1 P00519 1/20 0.43
▸ CDK1 P06493 1/20 0.43
▸ PDGFRB P09619 1/20 0.43
▸ CDK4 P11802 1/20 0.43
▸ SRC P12931 1/20 0.43
▸ CCNB1 P14635 1/20 0.43
▸ CCNA2 P20248 1/20 0.43
▸ CCND1 P24385 1/20 0.43
▸ CDK2 P24941 1/20 0.43
▸ WEE1 P30291 1/20 0.43
▸ TTK P33981 1/20 0.43
▸ KDR P35968 1/20 0.43
▸ FLT3 P36888 1/20 0.43
▸ NEK2 P51955 1/20 0.43

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
SCHEMBL4010511 0.84 ITK (0.62) FGFR1ITK
SCHEMBL4011763 0.82 ITK (0.57) FGFR1ITK
SCHEMBL4008237 0.78 ITK (0.53) FGFR1ITK
SCHEMBL3921587 0.76 ITK (0.68) FGFR1ITKKDR
SCHEMBL3923370 0.74 ITK (0.62) FGFR1ITKPLK4CHEK1AURKA
SCHEMBL4008940 0.73 ITK (0.50) FGFR1ITKCHEK1CDK4CCNA2
SCHEMBL13844043 0.72 ITK (0.57) FGFR1ITK
SCHEMBL3919611 0.72 ITK (0.58) FGFR1ITK
SCHEMBL144593 0.72 ITK (0.64) ITKTTK
SCHEMBL18392838 0.72 FGFR1 (1.00) FGFR1KDR

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-7473701-B2 Substituted indazoles, compositions containing them, method of production and use AVENTIS PHARMA S.A. (FR) 2009-01-06 — — US claimed
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