SCHEMBL20816634

SCHEMBL20816634

CC(C)CC(NC(=O)O)C(=O)NC(Cc1ccccc1)C(=O)C(=O)NCC(=O)NC(Cc1ccc2ccccc2c1)C(N)=O

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FCER2 P06734 2/20 0.52
CTSB P07858 1/20 0.49
MMP2 P08253 2/20 0.49
MMP9 P14780 2/20 0.49
MMP8 P22894 2/20 0.49
REN P00797 1/20 0.49
PSMB1 P20618 1/20 0.48
PSMB5 P28074 1/20 0.48
PSMB2 P49721 1/20 0.48
MMP1 P03956 1/20 0.48
OPRD1 P41143 4/20 0.47
OPRM1 P35372 3/20 0.47
OPRK1 P41145 2/20 0.47
CAPN1 P07384 2/20 0.47
PTPN1 P18031 1/20 0.47
KISS1R Q969F8 1/20 0.46

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
SCHEMBL20816950 1.00 FCER2 (0.52) FCER2CTSBMMP2MMP9MMP8
SCHEMBL20816946 1.00 FCER2 (0.52) FCER2CTSBMMP2MMP9MMP8
SCHEMBL20816587 0.94 OPRD1 (0.51) FCER2CTSBMMP2MMP9MMP8
SCHEMBL20816584 0.94 OPRD1 (0.51) FCER2CTSBMMP2MMP9MMP8
SCHEMBL20816782 0.92 OPRD1 (0.50) FCER2CTSBMMP2MMP9MMP8
SCHEMBL20816787 0.92 OPRD1 (0.50) FCER2CTSBMMP2MMP9MMP8
SCHEMBL20816577 0.92 OPRD1 (0.50) FCER2CTSBMMP2MMP9MMP8
SCHEMBL20816847 0.90 CTSB (0.50) FCER2CTSBMMP2MMP9MMP8
SCHEMBL20816610 0.90 CTSB (0.50) FCER2CTSBMMP2MMP9MMP8
SCHEMBL20827984 0.90 CAPN1 (0.62) CTSBRENCAPN1PTPN1

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-20190085024-A1 Alpha-Ketoamide Inhibitors Of Cysteine Proteases Phelix Therapeutics (US) 2019-03-21 US claimed
US-20190085024-A1 Alpha-Ketoamide Inhibitors Of Cysteine Proteases Phelix Therapeutics (US) 2019-03-21 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-20190085024-A1 Alpha-Ketoamide Inhibitors Of Cysteine Proteases CTSS, CTSB, CTSL FCER2 4241/4885CTSB 2/4885MMP2 107/4885

“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.