SCHEMBL4666086

SCHEMBL4666086

COc1ccc(S(=O)(=O)N(OC=O)c2ccc(Nc3cc(-c4ccc(OCCCN5CCCC5)cc4)ncn3)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 4/20 0.44
ABL1 P00519 12/20 0.43
BCR P11274 12/20 0.43
CYP3A4 P08684 1/20 0.41
FGFR3 P22607 1/20 0.41
PSEN1 P49768 1/20 0.40
PSEN2 P49810 1/20 0.40
APH1B Q8WW43 1/20 0.40
NCSTN Q92542 1/20 0.40
APH1A Q96BI3 1/20 0.40
PSENEN Q9NZ42 1/20 0.40
POLB P06746 1/20 0.39
MAPT P10636 1/20 0.39
KIT P10721 1/20 0.39

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
SCHEMBL4665705 0.96 CYP3A4 (0.44) HRH3ABL1BCRCYP3A4FGFR3
SCHEMBL4665832 0.93 MEN1 (0.44) HRH3ABL1BCRCYP3A4PSEN1
SCHEMBL4664290 0.91 ABL1 (0.43) ABL1BCRCYP3A4FGFR3
SCHEMBL4663885 0.90 FGFR3 (0.41) HRH3ABL1BCRCYP3A4FGFR3
SCHEMBL4665779 0.88 CXCR1 (0.47) ABL1BCRCYP3A4
SCHEMBL4664370 0.88 ABL1 (0.38) HRH3ABL1BCRPSEN1PSEN2
SCHEMBL4666192 0.86 ABL1 (0.42) ABL1BCR
SCHEMBL4667497 0.86 ABL1 (0.42) HRH3ABL1BCRCYP3A4
SCHEMBL4666180 0.86 ABL1 (0.40) HRH3ABL1BCRCYP3A4
SCHEMBL4665810 0.86 ABL1 (0.39) 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 HRH3 887/4885ABL1 24/4885BCR 402/4885

“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.