SCHEMBL1385291

SCHEMBL1385291

CCC[C@@H]1NCCNC1=O

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.43
USP2 O75604 1/20 0.43
TSHR P16473 2/20 0.42
LMNA P02545 2/20 0.42
GHSR Q92847 5/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
NPSR1 Q6W5P4 1/20 0.39
MLNR O43193 1/20 0.39
GLA P06280 1/20 0.39
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
CYP3A4 P08684 1/20 0.37
CYP2C19 P33261 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
SCHEMBL1385293 1.00 SMN1; SMN2 (0.43) SMN1; SMN2USP2TSHRLMNAGHSR
SCHEMBL13447330 0.88 SMN1; SMN2 (0.41) SMN1; SMN2USP2TSHRLMNAGHSR
SCHEMBL559663 0.86 SMN1; SMN2 (0.40) SMN1; SMN2USP2TSHRLMNAGHSR
SCHEMBL10022729 0.83
SCHEMBL4399382 0.83
SCHEMBL1344065 0.83
SCHEMBL20304122 0.81
SCHEMBL12552289 0.79 LMNA (0.39) SMN1; SMN2USP2TSHRLMNAL3MBTL1
SCHEMBL12552235 0.79 LMNA (0.42) SMN1; SMN2USP2TSHRLMNAL3MBTL1
SCHEMBL10842286 0.79 HDAC8 (0.57) SMN1; SMN2USP2TSHRLMNAGHSR

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4829449-B2 2011-12-07 JP claimed
JP-2003508353-A 2003-03-04 JP claimed
EP-1208097-A2 SUBSTITUTED OXOAZAHETEROCYCLYL COMPOUNDS Aventis Pharmaceuticals Inc. (US) 2002-05-29 EP claimed
WO-2001007436-A2 SUBSTITUTED OXOAZAHETEROCYCLYL COMPOUNDS AVENTIS PHARMACEUTICALS INC. (US) 2001-02-01 WO claimed
US-7612075-B2 Substituted oxoazaheterocyclyl compounds AVENTIS PHARMACEUTICALS INC. (US) 2009-11-03 US disclosed