SCHEMBL29655211

SCHEMBL29655211

CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](C)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NMT2 O60551 1/20 0.47
NMT1 P30419 1/20 0.47
TERT O14746 1/20 0.43
OPRM1 P35372 5/20 0.42
OPRD1 P41143 5/20 0.42
OPRK1 P41145 3/20 0.40
FURIN P09958 1/20 0.39
GNAI3 P08754 1/20 0.39
GNAO1 P09471 1/20 0.39
GNAI1 P63096 1/20 0.39
NPBWR1 P48145 1/20 0.38
ERAP2 Q6P179 1/20 0.38
ERAP1 Q9NZ08 1/20 0.38
LNPEP Q9UIQ6 1/20 0.38
CBX7 O95931 1/20 0.38
CDYL2 Q8N8U2 1/20 0.38
CBX8 Q9HC52 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
SCHEMBL29367177 0.92 NMT2 (0.46) NMT2NMT1
SCHEMBL29541660 0.92 NMT2 (0.46) NMT2NMT1
SCHEMBL30940023 0.92 NMT2 (0.46) NMT2NMT1
SCHEMBL23639482 0.88 NMT1 (0.51) NMT2NMT1OPRM1OPRD1OPRK1
Trifluoroacetic Acid SCHEMBL30645080 0.87 KEAP1 (0.43) NMT2NMT1OPRM1OPRD1OPRK1
SCHEMBL27639948 0.85 TERT (0.50) TERTOPRM1OPRD1OPRK1GNAI3
SCHEMBL1674765 0.85 TERT (0.50) TERTOPRM1OPRD1OPRK1GNAI3
SCHEMBL29817985 0.85 GSR (0.46) OPRK1GNAI3GNAO1GNAI1ERAP2
SCHEMBL29630439 0.85 GSR (0.46) OPRK1GNAI3GNAO1GNAI1ERAP2
SCHEMBL30636808 0.85 NMT1 (0.53) NMT2NMT1OPRM1OPRD1OPRK1

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
US-20240108040-A1 HIGH INTENSITY SWEETENERS FIRMENICH INCORPORATED (US) 2024-04-04 US disclosed
US-11758933-B2 High intensity sweeteners FIRMENICH INCORPORATED (US) 2023-09-19 US disclosed
EP-3368542-B1 HIGH INTENSITY SWEETENERS FIRMENICH INCORPORATED (US) 2022-06-22 EP disclosed
US-11357246-B2 High intensity sweeteners FIRMENICH INCORPORATED (US) 2022-06-14 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-20240108040-A1 HIGH INTENSITY SWEETENERS TAS2R40, TAS2R60, TAS1R1 NMT2 1105/4885NMT1 722/4885TERT 3724/4885
US-11357246-B2 High intensity sweeteners TAS2R40, TAS2R60, TAS1R1 NMT2 1105/4885NMT1 722/4885TERT 3724/4885
US-11758933-B2 High intensity sweeteners TAS2R40, TAS2R60, TAS1R1 NMT2 1105/4885NMT1 722/4885TERT 3724/4885

“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.