SCHEMBL20415667

SCHEMBL20415667

CC(C)(C)OC(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)NN

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CTSS P25774 8/20 0.56
▸ CTSK P43235 7/20 0.56
▸ CTSL P07711 2/20 0.55
▸ CTSB P07858 2/20 0.55
▸ PPARG P37231 1/20 0.53
▸ PPARA Q07869 1/20 0.53
▸ SCN9A Q15858 1/20 0.49
▸ CACNA1B Q00975 1/20 0.48
▸ HDAC8 Q9BY41 1/20 0.48
▸ AKT1 P31749 1/20 0.48
▸ BCL2 P10415 1/20 0.48
▸ ITGB3 P05106 1/20 0.47
▸ ITGA2B P08514 1/20 0.47
▸ ACE P12821 1/20 0.47

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
SCHEMBL2516660 1.00 CTSS (0.56) CTSSCTSKCTSLCTSBPPARG
SCHEMBL2516655 1.00 CTSS (0.56) CTSSCTSKCTSLCTSBPPARG
SCHEMBL20415725 0.88 CTSS (0.57) CTSSCTSKCTSLCTSBHDAC8
SCHEMBL31633736 0.88 CTSS (0.70) CTSSCTSKCTSLCTSBHDAC8
SCHEMBL13211222 0.87 CTSS (0.71) CTSSCTSKCTSLCTSBSCN9A
SCHEMBL3004474 0.87 CTSS (0.71) CTSSCTSKCTSLCTSBHDAC8
SCHEMBL5556757 0.87 CTSS (0.71) CTSSCTSKCTSLCTSBHDAC8
SCHEMBL18607925 0.87 PPARG (0.55) CTSSCTSKCTSLCTSBPPARG
SCHEMBL18262787 0.87 PPARG (0.55) CTSSCTSKCTSLCTSBPPARG
SCHEMBL3004471 0.87 CTSS (0.71) CTSSCTSKCTSLCTSBHDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10858314-B2 Urea derivative or pharmacologically acceptable salt thereof KYORIN PHARMACEUTICAL CO., LTD. (JP) 2020-12-08 — — US disclosed
US-20180208552-A1 UREA DERIVATIVE OR PHARMACOLOGICALLY ACCEPTABLE SALT THEREOF KYORIN PHARMACEUTICAL CO., LTD. (JP) 2018-07-26 — — 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 (2 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-10858314-B2 Urea derivative or pharmacologically acceptable salt thereof FPR1, SAAL1, FPR2 CTSS 1485/4885CTSK 2965/4885CTSL 157/4885
US-20180208552-A1 UREA DERIVATIVE OR PHARMACOLOGICALLY ACCEPTABLE SALT THEREOF FPR1, FPR2, SAAL1 CTSS 1488/4885CTSK 2892/4885CTSL 143/4885

“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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