SCHEMBL31452925

SCHEMBL31452925

CCOC(=O)C1CCN(CCNC(=O)OC(C)(C)C)CC1

nearest known ligand 0.66

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.66
KMT2A Q03164 2/20 0.66
ALDH1A1 P00352 2/20 0.66
TSHR P16473 1/20 0.66
CACNA1H O95180 1/20 0.48
LMNA P02545 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
DRD2 P14416 2/20 0.46
HTT P42858 2/20 0.46
GAA P10253 1/20 0.46
PKM P14618 1/20 0.46
JAK2 O60674 1/20 0.45
JAK1 P23458 1/20 0.45
MAPT P10636 2/20 0.45
RAB9A P51151 1/20 0.44
POLB P06746 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
KDM4E B2RXH2 1/20 0.44
THRB P10828 1/20 0.43

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
SCHEMBL22470192 0.88 DRD2 (0.52) MEN1KMT2AALDH1A1TSHRCACNA1H
SCHEMBL24811481 0.84 CACNA1H (0.52) MEN1KMT2AALDH1A1TSHRCACNA1H
SCHEMBL13136170 0.82 LMNA (0.52) MEN1KMT2AALDH1A1TSHRLMNA
SCHEMBL24897136 0.82 DRD2 (0.53) MEN1KMT2AALDH1A1TSHRDRD2
SCHEMBL852548 0.82 MEN1 (0.49) MEN1KMT2AALDH1A1TSHRCACNA1H
SCHEMBL852547 0.82 MEN1 (0.49) MEN1KMT2AALDH1A1TSHRCACNA1H
SCHEMBL14708214 0.81 CACNA1H (0.52) MEN1KMT2AALDH1A1TSHRCACNA1H
SCHEMBL16480069 0.81 CACNA1H (0.54) CACNA1HDRD2HTTJAK2JAK1
SCHEMBL32690155 0.81 DRD2 (0.47) MEN1KMT2AALDH1A1TSHRCACNA1H
SCHEMBL22703621 0.81 DRD2 (0.54) MEN1KMT2AALDH1A1TSHRCACNA1H

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-119968375-A Heterocyclic derivatives as Janus kinase inhibitors 奇斯药制品公司 2025-05-09 CN disclosed