SCHEMBL30797142

SCHEMBL30797142

O=C1NCCN1C1C2CCCC21

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HTR2C P28335 1/20 0.36
KMT2A Q03164 1/20 0.33
CDA P32320 2/20 0.32
OPRM1 P35372 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL17138583 0.78 KDM4E (0.39) KDM4EALDH1A1KMT2ACDAOPRM1
SCHEMBL9202125 0.74 KDM4E (0.39) KDM4EALDH1A1KMT2AOPRM1
SCHEMBL14244119 0.73
SCHEMBL3093245 0.72 PDE7A (0.41) KDM4EALDH1A1KMT2AOPRM1
SCHEMBL17977060 0.72 NPSR1 (0.33) ALDH1A1KMT2AL3MBTL1
SCHEMBL7358166 0.69 HSD11B1 (0.39) KDM4EALDH1A1
SCHEMBL19770247 0.68 SCN9A (0.37) KDM4EALDH1A1KMT2AOPRM1
SCHEMBL19770249 0.68 SCN9A (0.37) KDM4EALDH1A1KMT2AOPRM1
SCHEMBL726957 0.68 HTR2C (0.40) KDM4EALDH1A1HTR2CKMT2A
SCHEMBL17138754 0.68 CDA (0.42) KDM4EALDH1A1HTR2CKMT2ACDA

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
WO-2023244817-A1 SUBSTITUTED PIPERIDINES AS CK1A DEGRADERS MONTE ROSA THERAPEUTICS, INC. (US) 2023-12-21 WO disclosed