SCHEMBL32889362

SCHEMBL32889362

COc1ccc(C#N)c2c1OCCO2

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.50
KDM4E B2RXH2 2/20 0.50
LMNA P02545 2/20 0.50
HSD17B10 Q99714 1/20 0.50
IMPDH2 P12268 1/20 0.47
IMPDH1 P20839 1/20 0.47
USP2 O75604 1/20 0.47
AR P10275 8/20 0.41
MAPT P10636 1/20 0.40
MAOA P21397 2/20 0.37
MAOB P27338 2/20 0.37
HTT P42858 1/20 0.37
HTR2A P28223 1/20 0.36

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
SCHEMBL15988845 0.82 KDM4E (0.66) ALDH1A1KDM4ELMNAHSD17B10MAPT
SCHEMBL11339083 0.82 ALDH1A1 (0.54) ALDH1A1KDM4ELMNAHSD17B10IMPDH2
SCHEMBL19826862 0.76 TSHR (0.39) ALDH1A1KDM4EHSD17B10USP2AR
SCHEMBL18105502 0.76 SLC22A12 (0.32) MAOAMAOB
SCHEMBL6604319 0.75 KDM4E (0.46) ALDH1A1KDM4ELMNAHSD17B10USP2
SCHEMBL6605094 0.73 KDM4E (0.56) ALDH1A1KDM4ELMNAHSD17B10MAPT
SCHEMBL7124015 0.72 MAPKAPK2 (0.32) ALDH1A1KDM4ELMNAUSP2MAPT
SCHEMBL15988872 0.72 LMNA (0.59) ALDH1A1KDM4ELMNAHSD17B10MAPT
SCHEMBL32889359 0.72 LMNA (0.54) ALDH1A1KDM4ELMNAHSD17B10MAPT
SCHEMBL22064845 0.71 ROCK2 (0.34) AR

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-121758413-A Preparation method of 1- (5-methoxy-2, 3-dihydro-1, 4-benzodioxane-8-yl) ethanone 长沙贝塔医药科技有限公司 2026-03-31 CN disclosed