SCHEMBL19833260

SCHEMBL19833260

CC(C)(C)OC(=O)N[C@H](CC(=O)OCc1ccccc1)c1ccc(Cl)cc1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CACNA1B Q00975 1/20 0.51
▸ KLK5 Q9Y337 2/20 0.49
▸ KLK7 P49862 1/20 0.49
▸ SYK P43405 1/20 0.48
▸ MAPT P10636 2/20 0.48
▸ TP53 P04637 1/20 0.47
▸ PPARA Q07869 4/20 0.46
▸ CTSS P25774 1/20 0.43
▸ CTSL P07711 1/20 0.43
▸ ATM Q13315 1/20 0.43
▸ PPARG P37231 1/20 0.43
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42

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
SCHEMBL18133732 1.00 CACNA1B (0.51) CACNA1BKLK5KLK7SYKMAPT
SCHEMBL7299670 0.92 KLK5 (0.53) KLK5KLK7SYKMAPTPPARA
SCHEMBL917118 0.90 MAPT (0.49) CACNA1BKLK5KLK7SYKMAPT
SCHEMBL19829636 0.90 KLK5 (0.50) KLK5KLK7SYKMAPTPPARA
SCHEMBL30378756 0.89 CACNA1B (0.51) CACNA1BKLK5KLK7SYKMAPT
SCHEMBL19833252 0.87 KLK7 (0.48) KLK5KLK7SYKMAPTPPARA
SCHEMBL18133701 0.87 KLK7 (0.48) KLK5KLK7SYKMAPTPPARA
SCHEMBL1826013 0.84 SYK (0.47) KLK5KLK7SYKMAPTTP53
SCHEMBL4878275 0.84 MAPT (0.60) CACNA1BKLK5KLK7SYKMAPT
SCHEMBL390389 0.83 CACNA1B (0.45) CACNA1BMAPTTP53PPARACTSS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3280707-B1 BICYCLIC QUINAZOLINONE DERIVATIVES HOFFMANN LA ROCHE (CH) 2023-12-20 — — EP disclosed
US-20200317624-A1 BICYCLIC QUINAZOLINONE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2020-10-08 — — US disclosed
US-10676446-B2 Bicyclic quinazolinone derivatives HOFFMANN-LA ROCHE INC. (US) 2020-06-09 — — US disclosed
US-20180029996-A1 BICYCLIC QUINAZOLINONE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2018-02-01 — — 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 (3 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-20200317624-A1 BICYCLIC QUINAZOLINONE DERIVATIVES BRD4, BICRA, NDUFC2 CACNA1B 1078/4885KLK5 3218/4885KLK7 2573/4885
US-20180029996-A1 BICYCLIC QUINAZOLINONE DERIVATIVES BRD4, BICRA, NDUFC2 CACNA1B 1078/4885KLK5 3218/4885KLK7 2573/4885
US-10676446-B2 Bicyclic quinazolinone derivatives BRD4, BICRA, NDUFC2 CACNA1B 1078/4885KLK5 3218/4885KLK7 2573/4885

“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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