SCHEMBL30955459

SCHEMBL30955459

CN(C)C(=S)[C@@H]1C[C@@H](OCCC#N)CN1C(=O)OC(C)(C)C

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
UCHL1 P09936 1/20 0.34
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
NR1H2 P55055 1/20 0.33
CTSK P43235 1/20 0.32
AR P10275 1/20 0.31

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
SCHEMBL2499313 0.89 UCHL1 (0.39) UCHL1MEN1ALDH1A1MAPTKMT2A
SCHEMBL30955432 0.86 UCHL1 (0.31) UCHL1
SCHEMBL27020772 0.83 P2RX3 (0.38) UCHL1MEN1ALDH1A1MAPTKMT2A
SCHEMBL30955439 0.82 UCHL1 (0.34) UCHL1NR1H2
SCHEMBL30955413 0.82 UCHL1 (0.35) UCHL1NR1H2
SCHEMBL30955396 0.80 UCHL1 (0.35) UCHL1NR1H2
SCHEMBL30955415 0.79 MEN1 (0.36) UCHL1MEN1KMT2ANR1H2
SCHEMBL30955427 0.78 UCHL1 (0.38) UCHL1NR1H2
SCHEMBL30955464 0.78 MEN1 (0.36) UCHL1MEN1KMT2ANR1H2
SCHEMBL2494481 0.77 UCHL1 (0.40) UCHL1MEN1ALDH1A1MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4626548-A1 NON PEPTIDERGIC AGONISTS OF OXYTOCIN RECEPTOR Université de Strasbourg (FR) 2025-10-08 EP disclosed
WO-2024115667-A1 NON PEPTIDERGIC AGONISTS OF OXYTOCIN RECEPTOR UNIVERSITE DE STRASBOURG (FR) 2024-06-06 WO disclosed