SCHEMBL4072164

SCHEMBL4072164

O=C(N[C@@H](Cc1ccccc1)C(=O)NCNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.74

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CTSL P07711 10/20 0.74
CTSS P25774 5/20 0.74
CTSK P43235 5/20 0.74
CTSB P07858 5/20 0.65
L3MBTL1 Q9Y468 1/20 0.65
KMT2A Q03164 1/20 0.63
PSMB5 P28074 2/20 0.59
CTSV O60911 1/20 0.58
ACE P12821 2/20 0.57
PTPN1 P18031 1/20 0.56

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
SCHEMBL28714613 0.88 CTSL (0.71) CTSLCTSSCTSKCTSBL3MBTL1
SCHEMBL3498845 0.88 CTSL (0.71) CTSLCTSSCTSKCTSBL3MBTL1
SCHEMBL27520440 0.86 CTSL (0.68) CTSLCTSSCTSKCTSBL3MBTL1
SCHEMBL7417163 0.86 CTSL (0.68) CTSLCTSSCTSKCTSBL3MBTL1
SCHEMBL5517755 0.85 CTSL (1.00) CTSLCTSSCTSKCTSBCTSV
SCHEMBL6021768 0.85 CTSL (1.00) CTSLCTSSCTSKCTSBCTSV
SCHEMBL13956888 0.84 CTSL (0.70) CTSLCTSSCTSKCTSBL3MBTL1
SCHEMBL4357736 0.84 ACE (0.68) CTSLCTSSCTSKCTSBL3MBTL1
SCHEMBL29228939 0.84 CTSL (0.66) CTSLCTSSCTSKCTSBL3MBTL1
SCHEMBL4356229 0.84 ACE (0.68) CTSLCTSSCTSKCTSBL3MBTL1

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 4507/4885CTSS 4321/4885CTSK 2957/4885

“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.