SCHEMBL4665778

SCHEMBL4665778

O=S(=O)(Nc1ccc(Nc2cc(-c3cccc(OCCN4CCOCC4)c3)ncn2)cc1)c1ccc(F)cc1F

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 2/20 0.49
BCR P11274 2/20 0.49
PIK3CA P42336 4/20 0.49
PIK3R1 P27986 2/20 0.49
TP53 P04637 1/20 0.48
MAPK14 Q16539 4/20 0.45
EPHX2 P34913 5/20 0.43
MET P08581 1/20 0.43
AXL P30530 1/20 0.41
RET P07949 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
SCHEMBL4665847 0.92 ABL1 (0.51) ABL1BCRPIK3CAPIK3R1EPHX2
SCHEMBL4663979 0.89 ABL1 (0.50) ABL1BCREPHX2METAXL
SCHEMBL4666158 0.88 ABL1 (0.46) ABL1BCRPIK3CAPIK3R1MAPK14
SCHEMBL4667480 0.85 ABL1 (0.51) ABL1BCREPHX2
SCHEMBL4663917 0.85 ABL1 (0.48) ABL1BCRAXLRET
SCHEMBL4665611 0.84 ABL1 (0.49) ABL1BCREPHX2RET
SCHEMBL4664319 0.83 ABL1 (0.46) ABL1BCRPIK3CAPIK3R1TP53
SCHEMBL4664349 0.82 ABL1 (0.51) ABL1BCRMAPK14
SCHEMBL4663770 0.82 USP2 (0.51) ABL1BCRTP53
SCHEMBL4664333 0.81 TP53 (0.49) ABL1BCRTP53

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-20080242681-A1 N-4-(6-(Hetero)Aryl-Pyrimidin-4-Ylaminophenyl)-Benzenesulfonamides as Kinase Inhibitors ALTANA PHARMA AG (DE) 2008-10-02 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080242681-A1 N-4-(6-(Hetero)Aryl-Pyrimidin-4-Ylaminophenyl)-Benzenesulfonamides as Kinase Inhibitors MAP3K19, MAP3K6, MAP3K20 ABL1 24/4885BCR 402/4885PIK3CA 161/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.