SCHEMBL4665810

SCHEMBL4665810

COc1ccc(S(=O)(=O)N(OC=O)c2ccc(Nc3cc(-c4ccc5c(ccn5CCN5CCCC5)c4)ncn3)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 14/20 0.39
BCR P11274 14/20 0.39
HTR6 P50406 1/20 0.36
TP53 P04637 1/20 0.35
TNNI3K Q59H18 1/20 0.35
CCNT1 O60563 1/20 0.34
CDK9 P50750 1/20 0.34
EGFR P00533 1/20 0.34
LIMK1 P53667 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
SCHEMBL4664370 0.96 ABL1 (0.38) ABL1BCRHTR6TP53TNNI3K
SCHEMBL4667474 0.94 BACE1 (0.35) ABL1BCRHTR6TP53EGFR
SCHEMBL4666209 0.91 ABL1 (0.38) ABL1BCRTP53TNNI3KEGFR
SCHEMBL4666098 0.90 BPTF (0.35) ABL1BCRHTR6TP53
SCHEMBL4664340 0.89 BACE1 (0.35) ABL1BCRTP53TNNI3KEGFR
SCHEMBL4666028 0.89 ABL1 (0.38) ABL1BCRTNNI3KCCNT1CDK9
SCHEMBL4665744 0.89 MEN1 (0.38) ABL1BCRHTR6TP53EGFR
SCHEMBL4664313 0.88 HTR6 (0.42) ABL1BCRHTR6TNNI3KCCNT1
SCHEMBL4665757 0.88 HTR6 (0.35) ABL1BCRHTR6TP53EGFR
SCHEMBL4665626 0.87 BPTF (0.39) ABL1BCRHTR6CCNT1CDK9

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 402/4885HTR6 826/4885

“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.