SCHEMBL30987491

SCHEMBL30987491

CC1CCN(OCC(O)CN2CCN(C)CC2)CC1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.51
MEN1 O00255 3/20 0.51
KDM4E B2RXH2 2/20 0.50
GLA P06280 1/20 0.50
TSHR P16473 2/20 0.49
NPSR1 Q6W5P4 1/20 0.46
USP2 O75604 1/20 0.45
LMNA P02545 4/20 0.44
CHRNA7 P36544 1/20 0.44
NPY1R P25929 1/20 0.44
NPY2R P49146 1/20 0.44
RAB9A P51151 1/20 0.43
ALDH1A1 P00352 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
HTT P42858 1/20 0.40
RAD52 P43351 1/20 0.40
MAPT P10636 1/20 0.39

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
SCHEMBL30987489 0.86 KMT2A (0.52) KMT2AMEN1KDM4ETSHRNPSR1
SCHEMBL30987486 0.86 KMT2A (0.52) KMT2AMEN1KDM4ETSHRNPSR1
SCHEMBL30987494 0.86 KMT2A (0.56) KMT2AMEN1TSHRNPSR1USP2
SCHEMBL30987497 0.86 KMT2A (0.52) KMT2AMEN1KDM4ETSHRNPSR1
SCHEMBL30987492 0.82 KMT2A (0.48) KMT2AMEN1KDM4ETSHRNPSR1
SCHEMBL13013046 0.74 KMT2A (0.64) KMT2AMEN1KDM4ETSHRNPSR1
SCHEMBL23657198 0.73 KDM4E (0.62) KMT2AMEN1KDM4EGLATSHR
SCHEMBL13180324 0.73 KDM4E (0.62) KMT2AMEN1KDM4EGLATSHR
SCHEMBL23657255 0.73 KDM4E (0.62) KMT2AMEN1KDM4EGLATSHR
SCHEMBL25493697 0.72 KDM4E (0.57) KMT2AMEN1KDM4EGLATSHR

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-118139842-A Oximes and their use in the treatment of GBA related diseases 泽拉丹麦有限公司 2024-06-04 CN disclosed