SCHEMBL17194114

SCHEMBL17194114

CC(C)(C)OC(=O)NC(CCc1ccc2cc(CCCCNC(=O)OCc3ccccc3)ccc2c1)C(N)=O

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.54
▸ KLK7 P49862 2/20 0.51
▸ KLK5 Q9Y337 2/20 0.51
▸ SIRT2 Q8IXJ6 1/20 0.49
▸ CTSK P43235 3/20 0.48
▸ CTSS P25774 3/20 0.48
▸ ITGB3 P05106 1/20 0.48
▸ ITGA2B P08514 1/20 0.48
▸ CTSB P07858 2/20 0.47
▸ TGM2 P21980 1/20 0.46
▸ HTRA1 Q92743 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ PTPN1 P18031 1/20 0.45
▸ CASP1 P29466 1/20 0.45
▸ CTSL P07711 1/20 0.44
▸ FOLH1 Q04609 1/20 0.44
▸ SYK P43405 1/20 0.44

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
SCHEMBL15802558 1.00 MAPT (0.54) MAPTKLK7KLK5SIRT2CTSK
SCHEMBL15802458 0.94 MAPT (0.58) MAPTKLK7KLK5SIRT2CTSK
SCHEMBL15802597 0.92 MAPT (0.49) MAPTKLK7KLK5SIRT2ITGB3
SCHEMBL15834361 0.92 SIRT2 (0.55) SIRT2CTSSCTSBTGM2SMN1; SMN2
SCHEMBL937072 0.87 MAPT (0.54) MAPTKLK7KLK5SIRT2CTSK
SCHEMBL2801427 0.87 MAPT (0.66) MAPTKLK7KLK5SIRT2ITGB3
SCHEMBL2801426 0.87 MAPT (0.66) MAPTKLK7KLK5SIRT2ITGB3
SCHEMBL15802557 0.86 CTSS (0.45) MAPTKLK7KLK5SIRT2CTSK
SCHEMBL17194115 0.86 CTSS (0.45) MAPTKLK7KLK5SIRT2CTSK
SCHEMBL5425732 0.86 MAPT (0.62) MAPTKLK7KLK5SIRT2CTSK

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-20150299142-A1 3,5-DIAMINO-6-CHLORO-N-(4-PHENYLBUTYL)CARBAMIMIDOYL) PYRAZINE-2-CARBOXAMIDE COMPOUNDS PARION SCIENCES, INC. (US) 2015-10-22 — — 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-20150299142-A1 3,5-DIAMINO-6-CHLORO-N-(4-PHENYLBUTYL)CARBAMIMIDOYL) PYRAZINE-2-CARBOXAMIDE COMPOUNDS CFTR, SCNN1B, SCN5A MAPT 4075/4885KLK7 2163/4885KLK5 514/4885

“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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