SCHEMBL21176324

SCHEMBL21176324

CC(C)CNC(=O)C(O)C(C)N(C=O)CC(C)(C)C

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.34
CYP2C19 P33261 1/20 0.34
MMP1 P03956 1/20 0.34
MMP8 P22894 1/20 0.34
ANPEP P15144 1/20 0.32
DNPEP Q9ULA0 1/20 0.32
CNR2 P34972 4/20 0.31
PPARG P37231 2/20 0.31
PPARD Q03181 2/20 0.31
PPARA Q07869 2/20 0.31
CNR1 P21554 2/20 0.31
KDM4E B2RXH2 1/20 0.31
POLB P06746 1/20 0.31
HPGD P15428 1/20 0.30

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
SCHEMBL19974987 0.87 CYP2D6 (0.33) CYP2D6CYP2C19MMP1MMP8ANPEP
SCHEMBL19974715 0.82 METAP2 (0.30)
SCHEMBL19974882 0.81 KMT2A (0.38)
SCHEMBL21183507 0.77 CTSD (0.36) CYP2D6CYP2C19MMP1MMP8ANPEP
SCHEMBL19975120 0.76 CYP2D6 (0.36) CYP2D6CYP2C19MMP1MMP8CNR2
SCHEMBL19974711 0.74 MEN1 (0.49) MMP1MMP8ANPEPDNPEPCNR2
SCHEMBL21176216 0.69 KMT2A (0.42) CYP2D6CYP2C19ANPEPDNPEPKDM4E
SCHEMBL19974679 0.68 KMT2A (0.36)
SCHEMBL21176348 0.68 ADH1A (0.47) CYP2D6CYP2C19MMP1MMP8KDM4E
SCHEMBL19975074 0.67 CYP2D6 (0.39) CYP2D6CYP2C19MMP1MMP8ANPEP

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-20220356148-A1 ANTIVIRAL COMPOUNDS HAPLOGEN GMBH (AT) 2022-11-10 US disclosed
US-11091428-B2 Antiviral compounds HAPLOGEN GMBH (AT) 2021-08-17 US disclosed
US-11091428-B2 Antiviral compounds HAPLOGEN GMBH (AT) 2021-08-17 US disclosed
CN-110062753-A Antiviral compounds 哈普洛根有限责任公司 2019-07-26 CN disclosed
US-20190225575-A1 ANTIVIRAL COMPOUNDS LUNIS CONSULTING GMBH (AT) 2019-07-25 US disclosed
US-20190225575-A1 ANTIVIRAL COMPOUNDS LUNIS CONSULTING GMBH (AT) 2019-07-25 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-20190225575-A1 ANTIVIRAL COMPOUNDS PLA2G1B, PLA2G12A, PLA2G4C CYP2D6 798/4885CYP2C19 3198/4885MMP1 3062/4885
US-20220356148-A1 ANTIVIRAL COMPOUNDS PLA2G12A, PLA2G1B, PLA2G4C CYP2D6 562/4885CYP2C19 3143/4885MMP1 3363/4885
US-11091428-B2 Antiviral compounds PLA2G1B, PLA2G12A, PLA2G4C CYP2D6 798/4885CYP2C19 3198/4885MMP1 3062/4885

“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.