SCHEMBL30955441

SCHEMBL30955441

CC(=O)O[C@@H]1C[C@@H](C(=O)N(C)C)N(C(=O)OC(C)(C)C)C1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
UCHL1 P09936 1/20 0.43
NR1H2 P55055 1/20 0.34
CYP1A2 P05177 1/20 0.34
POLB P06746 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C19 P33261 1/20 0.34
CHRM2 P08172 3/20 0.33
CHRM1 P11229 3/20 0.33
CHRM3 P20309 3/20 0.33
CHRM4 P08173 2/20 0.33
CHRM5 P08912 2/20 0.33
MCL1 Q07820 2/20 0.33
HSD17B10 Q99714 1/20 0.32
JAK2 O60674 1/20 0.31
JAK1 P23458 1/20 0.31
USP30 Q70CQ3 1/20 0.31
HSD11B1 P28845 2/20 0.31
NPC1 O15118 1/20 0.31
HTRA1 Q92743 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
SCHEMBL30955475 0.94 CYP1A2 (0.42) UCHL1NR1H2CYP1A2POLBCYP3A4
SCHEMBL30955410 0.93 UCHL1 (0.39) UCHL1NR1H2CYP1A2POLBCYP3A4
SCHEMBL30955427 0.87 UCHL1 (0.38) UCHL1NR1H2CYP1A2POLBCYP3A4
SCHEMBL5359255 0.86 UCHL1 (0.54) UCHL1NR1H2CYP1A2POLBCYP3A4
SCHEMBL2498537 0.86 UCHL1 (0.41) UCHL1NR1H2CYP1A2POLBCYP3A4
SCHEMBL3843496 0.85 HSD17B10 (0.39) UCHL1NR1H2CYP1A2POLBCYP3A4
SCHEMBL2248123 0.85 HSD17B10 (0.39) UCHL1NR1H2CYP1A2POLBCYP3A4
SCHEMBL13375877 0.85 HSD17B10 (0.39) UCHL1NR1H2CYP1A2POLBCYP3A4
SCHEMBL5352509 0.83 UCHL1 (0.42) UCHL1NR1H2CYP1A2POLBCYP3A4
SCHEMBL6847866 0.82 MMP2 (0.42) UCHL1NR1H2CYP1A2POLBCYP3A4

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