SCHEMBL30968489

SCHEMBL30968489

CC(C)(C)OC(=O)N1CCNCC1c1cc2c(cn1)CC(NC(=O)OCc1ccccc1)CC2

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.45
CA2 P00918 2/20 0.45
ACHE P22303 2/20 0.45
HDAC8 Q9BY41 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
RORC P51449 4/20 0.40
MAPT P10636 2/20 0.39
MAPK1 P28482 2/20 0.39
NPSR1 Q6W5P4 2/20 0.39
NTSR1 P30989 1/20 0.39
CTSL P07711 1/20 0.39
CTSB P07858 1/20 0.39
CTSK P43235 1/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
ALDH1A1 P00352 2/20 0.38
POLB P06746 1/20 0.38
CCNT1 O60563 2/20 0.38
GPR119 Q8TDV5 1/20 0.38
TLR4 O00206 1/20 0.37

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
SCHEMBL30968564 0.86 CA1 (0.44) CA1CA2ACHEHDAC8L3MBTL1
SCHEMBL30968455 0.82 CA1 (0.42) CA1CA2ACHEHDAC8L3MBTL1
SCHEMBL30968474 0.80 CA1 (0.44) CA1CA2ACHEL3MBTL1RORC
SCHEMBL30059845 0.78 ACHE (0.49) CA1CA2ACHEHDAC8L3MBTL1
SCHEMBL20722411 0.78 ACHE (0.49) CA1CA2ACHEHDAC8L3MBTL1
SCHEMBL21685571 0.78 ACHE (0.49) CA1CA2ACHEHDAC8L3MBTL1
SCHEMBL30968505 0.78 PARP1 (0.38) ACHEMAPTALDH1A1GPR119
SCHEMBL30968492 0.77 PARP1 (0.45) MAPTALDH1A1
SCHEMBL27620945 0.73 NPC1 (0.41) L3MBTL1RORCCTSLMEN1KMT2A
SCHEMBL16409216 0.72 CTSL (0.50) CA1CA2ACHEL3MBTL1MAPT

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
CN-112867712-B Carboxamide as ubiquitin-specific protease inhibitor 瓦洛早期发现股份有限公司 2024-07-16 CN disclosed