SCHEMBL4665820

SCHEMBL4665820

O=S(=O)(Nc1ccc(Nc2cc(-c3ccc(OCCCN4CCOCC4)cc3)ncn2)cc1)c1ccccc1F

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 6/20 0.48
BCR P11274 6/20 0.48
NFE2L2 Q16236 3/20 0.44
EPHX2 P34913 3/20 0.44
UBE2N P61088 1/20 0.43
HRH3 Q9Y5N1 1/20 0.43
KIT P10721 1/20 0.43
EGFR P00533 1/20 0.42
MET P08581 1/20 0.42
SRC P12931 1/20 0.42
AXL P30530 1/20 0.42
MCL1 Q07820 1/20 0.42

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
SCHEMBL4663917 0.96 ABL1 (0.48) ABL1BCRSRCAXL
SCHEMBL4663979 0.92 ABL1 (0.50) ABL1BCRNFE2L2EPHX2EGFR
SCHEMBL4666158 0.92 ABL1 (0.46) ABL1BCREPHX2KITAXL
SCHEMBL4664346 0.91 ABL1 (0.50) ABL1BCRNFE2L2EPHX2HRH3
Formic Acid SCHEMBL4667496 0.89 ABL1 (0.45) ABL1BCRHRH3EGFRMET
SCHEMBL4665847 0.88 ABL1 (0.51) ABL1BCREPHX2METAXL
Formic Acid SCHEMBL4663988 0.88 AXL (0.46) ABL1BCREGFRMETSRC
SCHEMBL4664349 0.87 ABL1 (0.51) ABL1BCRSRC
SCHEMBL4663820 0.87 ABL1 (0.47) ABL1BCRSRCAXL
Formic Acid SCHEMBL4664337 0.86 ABL1 (0.42) ABL1BCR

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 402/4885NFE2L2 1996/4885

“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.