SCHEMBL2417533

SCHEMBL2417533

CCC(C)[C@H](NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)c1ccccc1)C(=O)NCCCCCCNC(=O)[C@H](NC(=O)[C@@H](Cc1cnc[nH]1)NC(=O)c1ccccc1)C(C)CC

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
REN P00797 13/20 0.47
CTSB P07858 1/20 0.47
CTSK P43235 1/20 0.47
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
ITGB2 P05107 1/20 0.46
ICAM1 P05362 1/20 0.46
ITGAL P20701 1/20 0.46
PGA5 P0DJD9 1/20 0.45

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
SCHEMBL2417390 1.00 REN (0.47) RENCTSBCTSKCA1CA2
SCHEMBL2412039 1.00 REN (0.47) RENCTSBCTSKCA1CA2
SCHEMBL2416964 1.00 REN (0.47) RENCTSBCTSKCA1CA2
SCHEMBL2416389 1.00 REN (0.47) RENCTSBCTSKCA1CA2
SCHEMBL2418114 1.00 REN (0.47) RENCTSBCTSKCA1CA2
SCHEMBL2416946 1.00 REN (0.47) RENCTSBCTSKCA1CA2
SCHEMBL2421544 1.00 REN (0.47) RENCTSBCTSKCA1CA2
SCHEMBL2417562 0.99 REN (0.48) RENCTSBCTSKCA1CA2
SCHEMBL2418628 0.97 REN (0.48) RENCTSBCTSKCA1CA2
SCHEMBL2420134 0.92 REN (0.49) RENCTSBCTSKCA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2365052-B1 pH tuneable-gellant for use in consumer product compositions PROCTER & GAMBLE (US) 2016-07-13 EP claimed
US-8236748-B2 pH tuneable amido-gellant for use in consumer product compositions THE PROCTER & GAMBLE COMPANY (US) 2012-08-07 US claimed
US-20110224124-A1 pH Tuneable Amido-Gellant For Use In Consumer Product Compositions THE PROCTER & GAMBLE COMPANY 2011-09-15 US claimed
EP-2365052-A1 pH tuneable-gellant for use in consumer product compositions The Procter & Gamble Company (US) 2011-09-14 EP claimed
EP-2365052-B1 pH tuneable-gellant for use in consumer product compositions PROCTER & GAMBLE (US) 2016-07-13 EP disclosed
EP-2365052-A1 pH tuneable-gellant for use in consumer product compositions The Procter & Gamble Company (US) 2011-09-14 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-20110224124-A1 pH Tuneable Amido-Gellant For Use In Consumer Product Compositions AGPAT2, AGPAT5, GNAO1 REN 2577/4885CTSB 2166/4885CTSK 1752/4885

“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.