SCHEMBL29514552

SCHEMBL29514552

CC(C)(C)OC(=O)N1CCC1c1ccncc1

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 4/20 0.48
GPR119 Q8TDV5 7/20 0.46
PRMT5 O14744 1/20 0.44
WDR77 Q9BQA1 1/20 0.44
USP30 Q70CQ3 1/20 0.43
NR1H2 P55055 3/20 0.42
NR1H3 Q13133 3/20 0.42
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL3261075 0.92 PRMT5 (0.53) RIPK1GPR119PRMT5WDR77ALDH1A1
SCHEMBL27504373 0.85 RIPK1 (0.66) RIPK1GPR119NR1H2NR1H3
SCHEMBL27703992 0.84 GPR119 (0.53) RIPK1GPR119PRMT5WDR77ALDH1A1
SCHEMBL30675171 0.84 GPR119 (0.53) RIPK1GPR119PRMT5WDR77ALDH1A1
SCHEMBL2148828 0.83 RIPK1 (0.48) RIPK1NR1H2NR1H3
SCHEMBL14880733 0.83 NR1H2 (0.54) RIPK1NR1H2NR1H3
SCHEMBL26115692 0.83 PARP1 (0.43) RIPK1GPR119PRMT5WDR77USP30
SCHEMBL29665905 0.83 RIPK1 (0.40) RIPK1GPR119PRMT5WDR77USP30
SCHEMBL38661096 0.82 NR1H2 (0.47) RIPK1GPR119USP30NR1H2NR1H3
SCHEMBL29514535 0.81 PARP1 (0.39) RIPK1GPR119PRMT5WDR77USP30

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
CN-115003667-B TYK-2 inhibitors 百济神州有限公司 2025-04-15 CN disclosed
CN-114181205-A Pyrazolopyridine compound or salt thereof, and preparation method and application thereof 上海辉启生物医药科技有限公司 2022-03-15 CN disclosed