SCHEMBL29952967

SCHEMBL29952967

COC(=O)c1cnc(C=O)n1C

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.46
RAB9A P51151 2/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
NPC1 O15118 2/20 0.44
MAPT P10636 1/20 0.41
KDM4E B2RXH2 3/20 0.38
ALDH1A1 P00352 4/20 0.37
L3MBTL1 Q9Y468 2/20 0.36
MAPK1 P28482 3/20 0.35
NPSR1 Q6W5P4 2/20 0.33
GAA P10253 1/20 0.33
ATM Q13315 1/20 0.33
HTT P42858 1/20 0.33
LMNA P02545 1/20 0.33
ALOX15 P16050 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
SCHEMBL23421827 0.92 SMN1; SMN2 (0.41) SMN1; SMN2RAB9AMEN1KMT2ANPC1
SCHEMBL23422001 0.89 SMN1; SMN2 (0.41) SMN1; SMN2RAB9AMEN1KMT2ANPC1
SCHEMBL23421998 0.85 SMN1; SMN2 (0.45) SMN1; SMN2RAB9AMEN1KMT2ANPC1
SCHEMBL23235966 0.80 MEN1 (0.36) MEN1KMT2AKDM4EALDH1A1L3MBTL1
SCHEMBL23420924 0.79 SMN1; SMN2 (0.37) SMN1; SMN2RAB9AMEN1KMT2ANPC1
SCHEMBL23422043 0.77 SMN1; SMN2 (0.40) SMN1; SMN2RAB9AMEN1KMT2ANPC1
SCHEMBL21879984 0.77 ATM (0.31) ATM
SCHEMBL10579577 0.77 SMN1; SMN2 (0.52) SMN1; SMN2RAB9AMEN1KMT2ANPC1
SCHEMBL6344541 0.75 SMN1; SMN2 (0.48) SMN1; SMN2RAB9AMEN1KMT2ANPC1
SCHEMBL8081105 0.75 SMN1; SMN2 (0.48) SMN1; SMN2RAB9AMEN1KMT2ANPC1

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
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed