SCHEMBL29205339

SCHEMBL29205339

CCOC(=O)C1OC(C)CC1=O

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.41
MAPT P10636 2/20 0.41
KDM4E B2RXH2 2/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
GAA P10253 1/20 0.41
HPGD P15428 1/20 0.41
HSD17B10 Q99714 1/20 0.41
PPM1B O75688 1/20 0.39
PTPN1 P18031 1/20 0.39
PPP1CC P36873 1/20 0.39
RAB9A P51151 1/20 0.39
TSHR P16473 1/20 0.38
LMNA P02545 1/20 0.37
ALOX12 P18054 1/20 0.35
TLR4 O00206 1/20 0.35

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
SCHEMBL31555465 0.79 PPM1B (0.43) ALDH1A1MAPTKDM4EKMT2AMEN1
SCHEMBL7383427 0.77 MAPK1 (0.41) GAA
SCHEMBL31580088 0.75 ALDH1A1 (0.40) ALDH1A1MAPTKDM4EKMT2AMEN1
SCHEMBL31579971 0.75 ALDH1A1 (0.40) ALDH1A1MAPTKDM4EKMT2AMEN1
SCHEMBL2200994 0.74 ALDH1A1 (0.38) ALDH1A1MAPTKDM4EKMT2AMEN1
SCHEMBL19933449 0.71 ALDH1A1 (0.37) ALDH1A1MAPTKDM4EKMT2AMEN1
SCHEMBL16534683 0.71 HPGD (0.41) ALDH1A1MAPTKDM4EKMT2AMEN1
SCHEMBL3196831 0.70 ALDH1A1 (0.56) ALDH1A1MAPTKDM4EKMT2AMEN1
SCHEMBL31536632 0.68 PPM1B (0.44) ALDH1A1MAPTKDM4EKMT2AMEN1
SCHEMBL6420484 0.68 PPM1B (0.44) ALDH1A1MAPTKDM4EKMT2AMEN1

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-119954784-A Compound, preparation method and application thereof 四川科伦药物研究院有限公司 2025-05-09 CN disclosed
CN-117999258-A GPR52 modulator compounds 赫普泰雅治疗有限公司 2024-05-07 CN disclosed