SCHEMBL4665682

SCHEMBL4665682

COc1ccc(S(=O)(=O)N(OC=O)c2ccc(Nc3cc(-c4ccc5c(c4)ncn5CCCN(C)C)ncn3)cc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 13/20 0.38
BCR P11274 13/20 0.38
TNNI3K Q59H18 1/20 0.35
BACE1 P56817 1/20 0.35
CCNE1 P24864 1/20 0.35
CDK2 P24941 1/20 0.35
HSF1 Q00613 1/20 0.35
MAPK1 P28482 2/20 0.34
BPTF Q12830 1/20 0.34
KDM4E B2RXH2 1/20 0.34
POLB P06746 1/20 0.34
MAPT P10636 1/20 0.34
CCNT1 O60563 1/20 0.34
CDK9 P50750 1/20 0.34
MEN1 O00255 1/20 0.34
USP2 O75604 1/20 0.34
ALDH1A1 P00352 1/20 0.34
TP53 P04637 1/20 0.34
CYP1A2 P05177 1/20 0.34
GLA P06280 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
SCHEMBL4666064 0.86 CYP1A2 (0.37) ABL1BCRBACE1CCNE1CDK2
SCHEMBL4663971 0.86 MAPK1 (0.37) ABL1BCRBACE1CCNE1CDK2
Formic Acid SCHEMBL4665678 0.85 HTT (0.41) ABL1BCRMAPTALDH1A1
SCHEMBL4664328 0.85 MAPK1 (0.36) ABL1BCRBACE1CCNE1CDK2
SCHEMBL4665626 0.85 BPTF (0.39) ABL1BCRBPTFCCNT1CDK9
SCHEMBL4667523 0.83 HTR6 (0.38) ABL1BCRTNNI3KBPTFCCNT1
SCHEMBL4664313 0.82 HTR6 (0.42) ABL1BCRTNNI3KBPTFCCNT1
SCHEMBL4664370 0.80 ABL1 (0.38) ABL1BCRTNNI3KBPTFTP53
SCHEMBL4666209 0.80 ABL1 (0.38) ABL1BCRTNNI3KBPTFMAPT
SCHEMBL4665810 0.78 ABL1 (0.39) ABL1BCRTNNI3KCCNT1CDK9

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 402/4885TNNI3K 25/4885

“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.