SCHEMBL25514744

SCHEMBL25514744

COC(=O)[C@@](C)(CCC(=O)N(C)Cc1ccccc1)NC(=O)OC(C)(C)C

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CTSL P07711 2/20 0.55
CTSB P07858 2/20 0.55
CTSS P25774 2/20 0.55
RAB9A P51151 4/20 0.52
NPC1 O15118 4/20 0.52
AKT1 P31749 3/20 0.49
KMT2A Q03164 3/20 0.49
RIPK1 Q13546 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
MEN1 O00255 2/20 0.43
MAPK1 P28482 2/20 0.43
ALDH1A1 P00352 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.40
HTT P42858 1/20 0.40
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA7 P43166 1/20 0.40
CA14 Q9ULX7 1/20 0.40

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
SCHEMBL25516318 0.78 KMT2A (0.42) CTSLCTSBCTSSAKT1KMT2A
SCHEMBL19742566 0.77 CTSL (0.57) CTSLCTSBCTSSRAB9ANPC1
SCHEMBL2210451 0.77 CA12 (0.49) CTSLCTSBCTSSAKT1KMT2A
SCHEMBL2210445 0.77 CA12 (0.49) CTSLCTSBCTSSAKT1KMT2A
SCHEMBL12360943 0.76 PPARA (0.51) CTSLCTSBCTSSAKT1KMT2A
SCHEMBL27962193 0.76 ALDH1A1 (0.42) AKT1KMT2ASMN1; SMN2MEN1ALDH1A1
SCHEMBL10268484 0.75 RAB9A (0.74) RAB9ANPC1KMT2ARIPK1SMN1; SMN2
SCHEMBL25507620 0.75 CTSS (0.53) CTSLCTSBCTSSRAB9ANPC1
SCHEMBL23849093 0.73 CTSS (0.50) CTSLCTSBCTSSRAB9ANPC1
SCHEMBL4254558 0.72 CTSL (0.57) CTSLCTSBCTSSRAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230151034-A1 PEPTIDOMIMETIC N5-METHYL-N2-(NONANOYL-L-LEUCYL)-L-GLUTAMINATE DERIVATIVES, TRIAZASPIRO[4.14]NONADECANE DERIVATIVES AND SIMILAR COMPOUNDS AS INHIBITORS OF NOROVIRUS AND CORONAVIRUS REPLICATION COCRYSTAL PHARMA, INC. 2023-05-18 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-20230151034-A1 PEPTIDOMIMETIC N5-METHYL-N2-(NONANOYL-L-LEUCYL)-L-GLUTAMINATE DERIVATIVES, TRIAZASPIRO[4.14]NONADECANE DERIVATIVES AND SIMILAR COMPOUNDS AS INHIBITORS OF NOROVIRUS AND CORONAVIRUS REPLICATION ASNS, GLUL, GNMT CTSL 161/4885CTSB 1180/4885CTSS 527/4885

“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.