SCHEMBL20722819

SCHEMBL20722819

O=C(NC1COc2cc(N3CC4CCC(C3)N4C(=O)O)ccc2C1)OCc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSL P07711 1/20 0.45
CTSB P07858 1/20 0.45
CTSK P43235 1/20 0.45
ALDH1A1 P00352 1/20 0.43
GAA P10253 1/20 0.43
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
ACHE P22303 2/20 0.42
TSHR P16473 1/20 0.41
EPHX1 P07099 1/20 0.39
DPP4 P27487 5/20 0.39
DPP7 Q9UHL4 5/20 0.39
TMEM97 Q5BJF2 2/20 0.39
SIGMAR1 Q99720 2/20 0.39
HSD11B1 P28845 1/20 0.38
HTR1A P08908 1/20 0.38
ADRA2C P18825 1/20 0.38
HRH2 P25021 1/20 0.38
HRH1 P35367 1/20 0.38
HRH3 Q9Y5N1 1/20 0.38

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
SCHEMBL20722775 0.97 CTSL (0.44) CTSLCTSBCTSKALDH1A1GAA
SCHEMBL30060163 0.90 CTSL (0.41) CTSLCTSBCTSKALDH1A1GAA
SCHEMBL20722437 0.90 CTSL (0.41) CTSLCTSBCTSKALDH1A1GAA
SCHEMBL20722630 0.88 KMT2A (0.44) CTSLCTSBCTSKALDH1A1GAA
SCHEMBL30061522 0.88 KMT2A (0.44) CTSLCTSBCTSKALDH1A1GAA
SCHEMBL20722778 0.85 CA1 (0.52) CTSLCTSBCTSKALDH1A1GAA
SCHEMBL20722954 0.85 ALDH1A1 (0.41) CTSLCTSBCTSKALDH1A1GAA
SCHEMBL21684716 0.84 ALDH1A1 (0.54) CTSLCTSBCTSKALDH1A1GAA
SCHEMBL20722808 0.84 ALDH1A1 (0.54) CTSLCTSBCTSKALDH1A1GAA
SCHEMBL30060112 0.83 DPP4 (0.46) CTSLCTSBCTSKALDH1A1GAA

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
US-11524966-B1 Carboxamides as ubiquitin-specific protease inhibitors VALO HEALTH, INC. (US) 2022-12-13 US disclosed
US-20210323975-A1 CARBOXAMIDES AS UBIQUITIN-SPECIFIC PROTEASE INHIBITORS VALO EARLY DISCOVERY, INC. 2021-10-21 US disclosed
EP-3833661-A1 CARBOXAMIDES AS UBIQUITIN-SPECIFIC PROTEASE INHIBITORS Valo Early Discovery, Inc. (US) 2021-06-16 EP disclosed
EP-3665169-A1 CARBOXAMIDES AS UBIQUITIN-SPECIFIC PROTEASE INHIBITORS Forma Therapeutics, Inc. (US) 2020-06-17 EP disclosed
WO-2020033707-A1 CARBOXAMIDES AS UBIQUITIN-SPECIFIC PROTEASE INHIBITORS FORMA THERAPEUTICS, INC. (US) 2020-02-13 WO disclosed
WO-2019032863-A1 CARBOXAMIDES AS UBIQUITIN-SPECIFIC PROTEASE INHIBITORS FORMA THERAPEUTICS, INC. (US) 2019-02-14 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-11524966-B1 Carboxamides as ubiquitin-specific protease inhibitors USP28, USP25, USP24 CTSL 400/4885CTSB 223/4885CTSK 453/4885
US-20210323975-A1 CARBOXAMIDES AS UBIQUITIN-SPECIFIC PROTEASE INHIBITORS USP28, USP25, USP24 CTSL 400/4885CTSB 223/4885CTSK 453/4885

“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.