SCHEMBL20204708

SCHEMBL20204708

CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@H](C=O)Cc1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 6/20 0.62
▸ CTSB P07858 5/20 0.58
▸ CTSL P07711 3/20 0.55
▸ CTSS P25774 3/20 0.55
▸ CTSK P43235 3/20 0.55
▸ PSMB1 P20618 1/20 0.54
▸ PSMB5 P28074 1/20 0.54
▸ PSMB2 P49721 1/20 0.54
▸ PSEN1 P49768 2/20 0.52
▸ PSEN2 P49810 2/20 0.52
▸ APH1B Q8WW43 2/20 0.52
▸ NCSTN Q92542 2/20 0.52
▸ APH1A Q96BI3 2/20 0.52
▸ PSENEN Q9NZ42 2/20 0.52
▸ MAPK1 P28482 1/20 0.52

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
SCHEMBL20204696 1.00 REN (0.62) RENCTSBCTSLCTSSCTSK
SCHEMBL28269148 0.91 CTSS (0.65) RENCTSBCTSLCTSSCTSK
SCHEMBL22962275 0.91 CTSS (0.65) RENCTSBCTSLCTSSCTSK
SCHEMBL20204700 0.91 CTSS (0.65) RENCTSBCTSLCTSSCTSK
SCHEMBL20204705 0.91 CTSS (0.65) RENCTSBCTSLCTSSCTSK
SCHEMBL30091422 0.89 REN (0.62) RENCTSBCTSLCTSSCTSK
SCHEMBL8527574 0.86 REN (0.65) RENCTSBCTSLCTSSCTSK
SCHEMBL1094506 0.86 ATM (0.62) CTSBCTSLCTSSCTSK
SCHEMBL7094 0.86 ATM (0.62) CTSBCTSLCTSSCTSK
SCHEMBL390555 0.86 ATM (0.62) CTSBCTSLCTSSCTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11124498-B2 Compositions and methods for modulating protease activity THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-09-21 — — US disclosed
US-20200048227-A1 COMPOSITIONS AND METHODS FOR MODULATING PROTEASE ACTIVITY THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2020-02-13 — — US disclosed
WO-2018097999-A1 COMPOSITIONS AND METHODS FOR MODULATING PROTEASE ACTIVITY THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2018-05-31 — — WO 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-11124498-B2 Compositions and methods for modulating protease activity RNASE1, ADAM8, CTRL REN 943/4885CTSB 8/4885CTSL 34/4885
US-20200048227-A1 COMPOSITIONS AND METHODS FOR MODULATING PROTEASE ACTIVITY RNASE1, ADAM8, CTRL REN 943/4885CTSB 8/4885CTSL 34/4885

“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.

Send feedback