SCHEMBL4070768

SCHEMBL4070768

O=C(N[C@@H](Cc1ccccc1)C(=O)NCNC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)OCc1ccccc1

nearest known ligand 0.76

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CTSL P07711 5/20 0.76
CTSB P07858 3/20 0.76
CTSS P25774 2/20 0.76
CTSK P43235 1/20 0.76
TACR1 P25103 2/20 0.70
ALDH1A1 P00352 1/20 0.60
ALOX15 P16050 1/20 0.60

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
SCHEMBL17643540 0.91 CTSL (0.76) CTSLCTSBCTSSCTSKTACR1
SCHEMBL7762796 0.90 CTSL (0.74) CTSLCTSBCTSSCTSKTACR1
SCHEMBL9557048 0.89 CTSL (0.73) CTSLCTSBCTSSCTSKTACR1
SCHEMBL18822607 0.89 CTSL (0.77) CTSLCTSBCTSSCTSKTACR1
SCHEMBL7314524 0.89 CTSL (0.73) CTSLCTSBCTSSCTSKTACR1
SCHEMBL9113871 0.89 CTSL (0.73) CTSLCTSBCTSSCTSKTACR1
SCHEMBL8335400 0.88 CTSL (0.71) CTSLCTSBCTSSCTSKTACR1
SCHEMBL8387597 0.88 CTSL (0.71) CTSLCTSBCTSSCTSKTACR1
SCHEMBL13073498 0.88 CTSL (0.71) CTSLCTSBCTSSCTSKTACR1
SCHEMBL7764124 0.88 CTSL (0.71) 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-8207107-B2 Di-amido gellant for use in consumer product compositions THE PROCTER & GAMBLE COMPANY (US) 2012-06-26 US disclosed
US-8168579-B2 Fluid detergent compositions comprising a di-amido gellant, and processes for making THE PROCTER AND GAMBLE COMPANY (US) 2012-05-01 US disclosed
US-20110224455-A1 Di-Amido Gellant For Use In Consumer Product Compositions THE PROCTER & GAMBLE COMPANY 2011-09-15 US disclosed
US-20110220536-A1 Fluid Detergent Compositions Comprising a Di-Amido Gellant, and Processes for Making THE PROCTER & GAMBLE COMPANY 2011-09-15 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-20110224455-A1 Di-Amido Gellant For Use In Consumer Product Compositions DAGLA, GNPAT, CDIPT CTSL 4507/4885CTSB 3509/4885CTSS 4321/4885

“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.