SCHEMBL19446156

SCHEMBL19446156

CCc1cncc(NS(=O)(=O)N(C)C)c1

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 7/20 0.58
▸ ALDH1A1 P00352 2/20 0.45
▸ PRMT6 Q96LA8 2/20 0.44
▸ PIK3C3 Q8NEB9 1/20 0.44
▸ POLB P06746 1/20 0.44
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ AR P10275 1/20 0.39
▸ HTT P42858 2/20 0.38
▸ PTGS1 P23219 1/20 0.36
▸ ADRB3 P13945 2/20 0.36
▸ PARP1 P09874 1/20 0.36

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
SCHEMBL23563123 0.81 HPGD (0.46) HPGDKMT2AARHTTPTGS1
SCHEMBL12314797 0.81 PIK3CB (0.51) HPGDALDH1A1KMT2AHTTPTGS1
SCHEMBL15034013 0.78 HPGD (0.55) HPGDALDH1A1PRMT6PIK3C3POLB
SCHEMBL18948385 0.77 BRD4 (0.38) HPGDKMT2APTGS1PARP1
SCHEMBL3093140 0.77 ALDH1A1 (0.47) HPGDALDH1A1PRMT6PIK3C3POLB
SCHEMBL11918321 0.76 HPGD (0.42) HPGDALDH1A1PRMT6PIK3C3POLB
SCHEMBL14194063 0.75 HPGD (0.65) HPGDALDH1A1POLBMEN1KMT2A
SCHEMBL19728973 0.74 ALDH1A1 (0.45) HPGDALDH1A1PRMT6PIK3C3POLB
SCHEMBL18948388 0.74 HPGD (0.48) HPGDALDH1A1PRMT6PIK3C3POLB
SCHEMBL4493666 0.74 HPGD (1.00) HPGDALDH1A1POLBMEN1KMT2A

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170360788-A1 SMALL MOLECULE INHIBITORS OF EGFR AND PI3K THE REGENTS OF THE UNIVERSITY OF MICHIGAN 2017-12-21 — — US disclosed
EP-2516417-B1 ISOINDOLINONE INHIBITORS OF PHOSPHATIDYLINOSITOL 3-KINASE VERTEX PHARMA (US) 2017-10-11 — — EP 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-20170360788-A1 SMALL MOLECULE INHIBITORS OF EGFR AND PI3K EGFR, ERBB2, ERBB3 HPGD 4313/4885ALDH1A1 4653/4885PRMT6 1640/4885

“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.

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