SCHEMBL25974508

SCHEMBL25974508

O=C1C[C@@H]2CCCCN2C(=O)N1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
BRCA1 P38398 1/20 0.44
ATM Q13315 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
ALDH1A1 P00352 5/20 0.34
OPRM1 P35372 1/20 0.34
OPRD1 P41143 1/20 0.34
OPRK1 P41145 1/20 0.34
OGFRL1 Q5TC84 1/20 0.34
GAA P10253 3/20 0.33
KDM4E B2RXH2 2/20 0.33
PARP1 P09874 1/20 0.33
PKM P14618 2/20 0.33
HPGD P15428 1/20 0.33
HSD17B10 Q99714 1/20 0.33
POLB P06746 1/20 0.33
MAPK1 P28482 1/20 0.32
CRBN Q96SW2 1/20 0.32

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
SCHEMBL10761357 1.00 MAPT (0.44) MAPTMEN1KMT2ABRCA1ATM
SCHEMBL31436228 1.00 MAPT (0.44) MAPTMEN1KMT2ABRCA1ATM
SCHEMBL5753755 0.94 MAPT (0.38) MAPTMEN1KMT2ABRCA1ATM
SCHEMBL25343411 0.94 MAPT (0.38) MAPTMEN1KMT2ABRCA1ATM
SCHEMBL31436247 0.94 MAPT (0.38) MAPTMEN1KMT2ABRCA1ATM
Oxalic Acid SCHEMBL31533523 0.87 PLA2G7 (0.37) MAPTMEN1KMT2ABRCA1ATM
SCHEMBL19370610 0.76 OPRM1 (0.40) MAPTALDH1A1OPRM1OPRD1OPRK1
SCHEMBL2139086 0.74
SCHEMBL9265057 0.74
SCHEMBL9265060 0.74

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-2023135528-A1 HETEROALICYCLIC DERIVATIVES AND THEIR USE IN THE TREATMENT OF CNS DISORDERS SUVEN LIFE SCIENCES LIMITED (IN) 2023-07-20 WO disclosed