SCHEMBL30797207

SCHEMBL30797207

COC[C@@H]1CNC(=O)N1c1ccc(C)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
ALDH1A1 P00352 3/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
REN P00797 1/20 0.36
CCR1 P32246 3/20 0.35
RXFP1 Q9HBX9 1/20 0.35
HSD11B1 P28845 1/20 0.35
F2 P00734 1/20 0.34
ELANE P08246 1/20 0.34
CTSG P08311 1/20 0.34
CMA1 P23946 1/20 0.34
CTRC Q99895 1/20 0.34
ALOX5 P09917 1/20 0.34
CCR2 P41597 1/20 0.34
MAPK1 P28482 1/20 0.34
ATM Q13315 1/20 0.34

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
SCHEMBL8305787 0.74 GAA (0.46) GAARAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL10196444 0.70 SYK (0.38)
SCHEMBL30797058 0.69 GAA (0.41) GAARAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL30797417 0.69 GAA (0.41) GAARAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL22546974 0.69 SLC6A2 (0.59) L3MBTL1
SCHEMBL20956896 0.68 FHIT (0.32) MEN1KMT2A
SCHEMBL23262553 0.67 L3MBTL1 (0.32) L3MBTL1ATM
SCHEMBL12082229 0.66 FFAR1 (0.56) L3MBTL1
SCHEMBL12082307 0.66 FFAR1 (0.56) L3MBTL1
SCHEMBL8572575 0.65 ALOX5 (0.34) GAASMN1; SMN2MEN1KMT2AALDH1A1

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