SCHEMBL31293653

SCHEMBL31293653

CC(C)(C)OC(=O)N1CC2(CC(N)C2)C1.CC(C)(C)OC(=O)N1CC2(CC(NC(=O)OCc3ccccc3)C2)C1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 4/20 0.53
ATXN2 Q99700 4/20 0.53
TSHR P16473 1/20 0.45
ALDH1A1 P00352 1/20 0.44
GAA P10253 1/20 0.44
ROCK2 O75116 1/20 0.43
DPP4 P27487 4/20 0.43
DPP7 Q9UHL4 4/20 0.43
KCNH2 Q12809 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.42
CTSL P07711 1/20 0.41
CTSB P07858 1/20 0.41
CTSK P43235 1/20 0.41
MAPT P10636 1/20 0.41
MAPK1 P28482 1/20 0.41
NTSR1 P30989 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
HSD11B1 P28845 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
SCHEMBL27081666 0.95 ENPP2 (0.57) ENPP2ATXN2TSHRALDH1A1GAA
SCHEMBL29691239 0.87 ENPP2 (0.49) ENPP2ATXN2TSHRALDH1A1GAA
SCHEMBL27172319 0.87 ENPP2 (0.57) ENPP2ATXN2ALDH1A1GAAL3MBTL1
SCHEMBL29179859 0.85 ENPP2 (0.48) ENPP2ATXN2TSHRALDH1A1GAA
SCHEMBL29984212 0.81 ENPP2 (0.62) ENPP2ATXN2TSHRALDH1A1GAA
SCHEMBL29232309 0.81 ALDH1A1 (0.53) TSHRALDH1A1GAADPP4DPP7
SCHEMBL27081081 0.81 ENPP2 (0.64) ENPP2ATXN2TSHRALDH1A1GAA
SCHEMBL30539370 0.80 ALDH1A1 (0.48) ENPP2ATXN2TSHRALDH1A1GAA
SCHEMBL18046548 0.80 ALDH1A1 (0.43) ENPP2ATXN2TSHRALDH1A1GAA
SCHEMBL16616151 0.79 SMN1; SMN2 (0.54) ENPP2ATXN2L3MBTL1NPSR1KMT2A

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
EP-4724439-A1 HETEROARYL DERIVATIVES AS DDRS INHIBITORS Chiesi Farmaceutici S.p.A. (IT) 2026-04-15 EP disclosed
WO-2024251855-A1 HETEROARYL DERIVATIVES AS DDRS INHIBITORS CHIESI FARMACEUTICI S.P.A. (IT) 2024-12-12 WO disclosed