SCHEMBL29116012

SCHEMBL29116012

CNC1CCN(C(=O)OC(C)(C)C)[C@H](c2cccc(F)c2)C1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 2/20 0.52
TACR1 P25103 1/20 0.42
GPR119 Q8TDV5 1/20 0.41
NR1H2 P55055 6/20 0.41
NR1H3 Q13133 5/20 0.41
HPGDS O60760 1/20 0.40
JAK2 O60674 2/20 0.40
NTRK1 P04629 2/20 0.40
PDE5A O76074 1/20 0.39
SSTR4 P31391 1/20 0.39
PSEN1 P49768 1/20 0.38
PSEN2 P49810 1/20 0.38
APH1B Q8WW43 1/20 0.38
NCSTN Q92542 1/20 0.38
APH1A Q96BI3 1/20 0.38
PSENEN Q9NZ42 1/20 0.38
RXRA P19793 2/20 0.38

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
SCHEMBL29892012 1.00 RIPK1 (0.52) RIPK1TACR1GPR119NR1H2NR1H3
SCHEMBL29116081 0.89 RIPK1 (0.49) RIPK1TACR1GPR119NR1H2NR1H3
SCHEMBL29891858 0.89 RIPK1 (0.49) RIPK1TACR1GPR119NR1H2NR1H3
SCHEMBL29891697 0.89 RIPK1 (0.49) RIPK1TACR1GPR119NR1H2NR1H3
SCHEMBL29115969 0.87 RIPK1 (0.48) RIPK1GPR119NR1H2NR1H3RXRA
SCHEMBL20012078 0.87 RIPK1 (0.48) RIPK1GPR119NR1H2NR1H3RXRA
SCHEMBL29116144 0.85 RIPK1 (0.54) RIPK1GPR119NR1H2NR1H3JAK2
SCHEMBL27077230 0.84 RIPK1 (0.49) RIPK1TACR1PDE5A
SCHEMBL469686 0.83 RIPK1 (0.73) RIPK1NR1H2NR1H3JAK2NTRK1
SCHEMBL17067869 0.83 RIPK1 (0.73) RIPK1NR1H2NR1H3JAK2NTRK1

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-117157285-A Pharmaceutical compounds as ubiquitin-specific protease 19 (USP 19) inhibitors 阿尔麦克探索有限公司 2023-12-01 CN disclosed