SCHEMBL2500844

SCHEMBL2500844

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

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
UCHL1 P09936 1/20 0.39
AVPR2 P30518 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
CYP1A2 P05177 1/20 0.32
POLB P06746 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C19 P33261 1/20 0.32
NR1H2 P55055 1/20 0.32
MCL1 Q07820 4/20 0.31
SRC P12931 6/20 0.31
P2RX3 P56373 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
SCHEMBL5352509 0.88 UCHL1 (0.42) UCHL1AVPR2CYP1A2POLBCYP3A4
SCHEMBL5071390 0.84 AVPR2 (0.35) AVPR2KMT2A
SCHEMBL28491555 0.81 NR1H2 (0.36) UCHL1MEN1KMT2ACYP1A2POLB
SCHEMBL28502069 0.81 NR1H2 (0.36) UCHL1MEN1KMT2ACYP1A2POLB
SCHEMBL2498537 0.81 UCHL1 (0.41) UCHL1AVPR2CYP1A2POLBCYP3A4
SCHEMBL2501733 0.81 UCHL1 (0.41) UCHL1AVPR2CYP1A2POLBCYP3A4
SCHEMBL2502694 0.79 UCHL1 (0.40) UCHL1CYP1A2POLBCYP3A4CYP2C19
SCHEMBL2494481 0.79 UCHL1 (0.40) UCHL1AVPR2MEN1KMT2ACYP1A2
SCHEMBL2495165 0.79 UCHL1 (0.40) UCHL1CYP1A2POLBCYP3A4CYP2C19
SCHEMBL5359255 0.79 UCHL1 (0.54) UCHL1AVPR2CYP1A2POLBCYP3A4

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-8030499-B2 1,3-dihydro-2H-indole-2-one compound and pyrrolidine-2-one compound fused with aromatic heterocycle TAISHO PHARMACEUTICAL CO., LTD. (JP) 2011-10-04 US disclosed