SCHEMBL29090938

SCHEMBL29090938

CC1CN(C(=O)O)CC(C)C1(C)O

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.32
APLNR P35414 1/20 0.30

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
SCHEMBL20898688 1.00 SMN1; SMN2 (0.32) SMN1; SMN2APLNR
SCHEMBL23523345 1.00 SMN1; SMN2 (0.32) SMN1; SMN2APLNR
SCHEMBL29090937 1.00 SMN1; SMN2 (0.32) SMN1; SMN2APLNR
SCHEMBL23523344 1.00 SMN1; SMN2 (0.32) SMN1; SMN2APLNR
SCHEMBL28856830 0.77 NAMPT (0.35) SMN1; SMN2
SCHEMBL20905503 0.72 NR1H2 (0.49) SMN1; SMN2
SCHEMBL12897446 0.72
SCHEMBL30395393 0.71 GRM1 (0.37) SMN1; SMN2APLNR
SCHEMBL29138292 0.71 GRIN2B (0.35) APLNR
SCHEMBL6325183 0.71 CHRNB2 (0.38)

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-116745291-A N- (2- (4-cyanothiazolidin-3-yl) -2-oxoethyl) -quinoline-4-carboxamide 阿斯利康(瑞典)有限公司 2023-09-12 CN disclosed
EP-3694331-B1 INDAZOLYL-SPIRO[2.3]HEXANE-CARBONITRILE DERIVATIVES AS LRRK2 INHIBITORS, PHARMACEUTICAL COMPOSITIONS, AND USES THEREOF MERCK SHARP & DOHME LLC (US) 2022-11-16 EP disclosed