SCHEMBL30797233

SCHEMBL30797233

COCc1cccc(N2C(=O)NC[C@H]2C)c1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MIF P14174 1/20 0.41
BRD4 O60885 2/20 0.39
CREBBP Q92793 2/20 0.39
SLC5A1 P13866 3/20 0.38
APP P05067 1/20 0.36
AGXT P21549 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
HCRTR1 O43613 1/20 0.34
HCRTR2 O43614 1/20 0.34
GRM7 Q14831 1/20 0.34
HTR2C P28335 1/20 0.34
TGFBR1 P36897 1/20 0.34
JAK1 P23458 1/20 0.34
GHSR Q92847 1/20 0.34
MGLL Q99685 1/20 0.33

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
SCHEMBL30797229 0.83 RET (0.36) BRD4CREBBPHTR2C
SCHEMBL21804941 0.76 ALOX5 (0.50) L3MBTL1MGLL
SCHEMBL21921407 0.76 ALOX5 (0.50) L3MBTL1MGLL
SCHEMBL21804897 0.76 ALOX5 (0.50) L3MBTL1MGLL
SCHEMBL30088143 0.76 ALOX5 (0.50) L3MBTL1MGLL
SCHEMBL31663152 0.74 GAA (0.44) L3MBTL1
SCHEMBL2234874 0.74 GAA (0.44) L3MBTL1
SCHEMBL7608835 0.69 MIF (0.42) MIFBRD4CREBBPSLC5A1APP
SCHEMBL19251341 0.67 AGXT (0.71) AGXTL3MBTL1HCRTR1HCRTR2
SCHEMBL18933602 0.67 AGXT (0.46) MIFAGXTJAK1GHSR

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