SCHEMBL27324746

SCHEMBL27324746

c1sc(CN2CCNCC2)nc1C1CC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BAZ2A Q9UIF9 2/20 0.44
ALOX15 P16050 1/20 0.37
SIGMAR1 Q99720 1/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
CXCR4 P61073 5/20 0.36
SCN1A P35498 2/20 0.36
SCN8A Q9UQD0 2/20 0.36
PLAT P00750 1/20 0.36
ALDH1A1 P00352 1/20 0.36
CTSL P07711 1/20 0.35
CTSB P07858 1/20 0.35
CTSS P25774 1/20 0.35
CTSK P43235 1/20 0.35
HRH3 Q9Y5N1 2/20 0.34
CHRM2 P08172 1/20 0.34
CHRM1 P11229 1/20 0.34
ADRA2C P18825 1/20 0.34
CCR2 P41597 1/20 0.34
CXCL12 P48061 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
SCHEMBL18306589 0.77 BAZ2A (0.43) BAZ2ASCN1ASCN8AALDH1A1HRH3
SCHEMBL1088574 0.76 BAZ2A (0.49) BAZ2AALOX15SIGMAR1MEN1KMT2A
SCHEMBL27870171 0.76 ALDH1A1 (0.45) BAZ2AALOX15SIGMAR1MEN1KMT2A
SCHEMBL21917001 0.73 HRH4 (0.42) BAZ2ASIGMAR1MEN1KMT2APLAT
SCHEMBL8114045 0.73 BAZ2A (0.46) BAZ2AALOX15PLATCTSBCTSS
SCHEMBL25145880 0.73 BAZ2A (0.41) BAZ2AALOX15SIGMAR1MEN1KMT2A
SCHEMBL4914482 0.73 BAZ2A (0.44) BAZ2AALOX15SIGMAR1MEN1KMT2A
SCHEMBL4914470 0.73 KMT2A (0.53) BAZ2AMEN1KMT2AALDH1A1CTSL
SCHEMBL27324327 0.73 BAZ2A (0.44) BAZ2AALOX15SIGMAR1MEN1KMT2A
SCHEMBL25146002 0.71 PDE10A (0.35) BAZ2AALOX15SIGMAR1MEN1KMT2A

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-2024088922-A1 HETEROCYCLIC COMPOUNDS AS INHIBITORS OF MONOACYLGLYCEROL LIPASE (MAGL) F. HOFFMANN-LA ROCHE AG (CH) 2024-05-02 WO disclosed