SCHEMBL4664370

SCHEMBL4664370

COc1ccc(S(=O)(=O)N(OC=O)c2ccc(Nc3cc(-c4ccc5c(ccn5CCCN5CCCC5)c4)ncn3)cc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 12/20 0.38
BCR P11274 12/20 0.38
TP53 P04637 1/20 0.37
NPC1 O15118 1/20 0.36
BPTF Q12830 2/20 0.35
HTR6 P50406 1/20 0.35
HRH3 Q9Y5N1 1/20 0.34
TNNI3K Q59H18 1/20 0.34
PSEN1 P49768 1/20 0.34
PSEN2 P49810 1/20 0.34
APH1B Q8WW43 1/20 0.34
NCSTN Q92542 1/20 0.34
APH1A Q96BI3 1/20 0.34
PSENEN Q9NZ42 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
SCHEMBL4665810 0.96 ABL1 (0.39) ABL1BCRTP53HTR6TNNI3K
SCHEMBL4666209 0.95 ABL1 (0.38) ABL1BCRTP53BPTFTNNI3K
SCHEMBL4666098 0.94 BPTF (0.35) ABL1BCRTP53BPTFHTR6
SCHEMBL4665744 0.93 MEN1 (0.38) ABL1BCRTP53BPTFHTR6
SCHEMBL4667474 0.90 BACE1 (0.35) ABL1BCRTP53BPTFHTR6
SCHEMBL4666150 0.90 BPTF (0.35) ABL1BCRTP53BPTFHTR6
SCHEMBL4665626 0.89 BPTF (0.39) ABL1BCRBPTFHTR6
SCHEMBL4667523 0.88 HTR6 (0.38) ABL1BCRBPTFHTR6TNNI3K
SCHEMBL4666086 0.88 HRH3 (0.44) ABL1BCRHRH3PSEN1PSEN2
SCHEMBL4666028 0.88 ABL1 (0.38) ABL1BCRTNNI3K

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 402/4885TP53 2301/4885

“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.