SCHEMBL30159909

SCHEMBL30159909

CC(C)(C)OC(=O)c1ccc(N2CCO[C@H](CN3CCNCC3)C2)cc1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 3/20 0.37
SIRT2 Q8IXJ6 1/20 0.35
SIRT1 Q96EB6 1/20 0.35
ALDH1A1 P00352 2/20 0.34
USP2 O75604 1/20 0.34
TSHR P16473 1/20 0.34
HSD17B10 Q99714 1/20 0.34
TRPA1 O75762 5/20 0.33
CASR P41180 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
LMNA P02545 2/20 0.33
MAPT P10636 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
USP30 Q70CQ3 1/20 0.33

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
SCHEMBL23536716 0.86 GPR119 (0.41) GPR119SIRT2SIRT1ALDH1A1TRPA1
SCHEMBL23536802 0.86 GPR119 (0.41) GPR119SIRT2SIRT1ALDH1A1TRPA1
SCHEMBL29058474 0.83 GPR119 (0.39) GPR119SIRT2SIRT1ALDH1A1USP2
SCHEMBL23594160 0.82 GPR119 (0.39) GPR119SIRT2SIRT1ALDH1A1TRPA1
SCHEMBL23536803 0.80 USP30 (0.35) GPR119LMNAUSP30
SCHEMBL28527377 0.80 GPR119 (0.46) GPR119ALDH1A1USP2TSHRHSD17B10
SCHEMBL23536816 0.79 NR1H2 (0.39) ALDH1A1TSHRMEN1KMT2ALMNA
SCHEMBL23536819 0.79 SIRT2 (0.33) GPR119SIRT2SIRT1TRPA1LMNA
SCHEMBL5536717 0.77 ALDH1A1 (0.55) GPR119ALDH1A1USP2TSHRHSD17B10
SCHEMBL1943999 0.77 USP2 (0.44) GPR119ALDH1A1USP2MEN1KMT2A

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
EP-4077309-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF ANDROGEN RECEPTOR Arvinas Operations, Inc. (US) 2022-10-26 EP disclosed