SCHEMBL1264469

SCHEMBL1264469

CC(NC(=O)C(Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)C(F)C(=O)C(F)C(=O)C(C)NC(=O)C(Cc1ccccc1)NC(=O)OCc1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CTSL P07711 5/20 0.61
▸ CTSB P07858 3/20 0.61
▸ CTSS P25774 1/20 0.61
▸ CTSK P43235 1/20 0.61
▸ TACR1 P25103 2/20 0.59
▸ CAPN1 P07384 2/20 0.57
▸ ALDH1A1 P00352 1/20 0.57
▸ ALOX15 P16050 1/20 0.57

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
SCHEMBL7600777 1.00 CTSL (0.61) CTSLCTSBCTSSCTSKTACR1
SCHEMBL2411802 0.89 TACR1 (0.66) CTSLCTSBCTSSCTSKTACR1
SCHEMBL7275662 0.89 CTSL (0.58) CTSLCTSBCTSSCTSKTACR1
SCHEMBL7275672 0.89 CTSL (0.58) CTSLCTSBCTSSCTSKTACR1
SCHEMBL1264475 0.88 CTSL (0.59) CTSLCTSBCTSSCTSKTACR1
SCHEMBL31397615 0.87 CAPN1 (0.72) CTSLCTSBCTSSCTSKTACR1
SCHEMBL9088735 0.87 CAPN1 (0.72) CTSLCTSBCTSSCTSKTACR1
SCHEMBL10967811 0.87 CAPN1 (0.72) CTSLCTSBCTSSCTSKTACR1
SCHEMBL7281206 0.87 CAPN1 (0.72) CTSLCTSBCTSSCTSKTACR1
SCHEMBL5484209 0.87 CAPN1 (0.72) CTSLCTSBCTSSCTSKTACR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7879574-B2 Folded peptide backbone each end of which is conjugated to a fluorophore, which when cleaved as by digestion with a protease, the fluorophores provide high intensity signals; histology ONCOIMMUNIN, INC. (US) 2011-02-01 — — US disclosed
US-20080199898-A1 COMPOSITIONS FOR THE DETECTION OF ENZYME ACTIVITY IN BIOLOGICAL SAMPLES AND METHODS OF USE THEREOF ONCOIMMUNIN, INC. (US) 2008-08-21 — — US disclosed
US-7312302-B2 Compositions for the detection of enzyme activity in biological samples and methods of use thereof ONCOLMMUNIN, INC. (US) 2007-12-25 — — US disclosed
US-20040096926-A1 Compositions for the detection of enzyme activity in biological samples and methods of use thereof ONCOIMMUNIN, INC. 2004-05-20 — — 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-20040096926-A1 Compositions for the detection of enzyme activity in biological samples and methods of use thereof PRSS3, PREP, CTRL CTSL 74/4885CTSB 56/4885CTSS 63/4885

“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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