SCHEMBL22792252

SCHEMBL22792252

CCc1cncc(NCc2cccnc2)n1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
ALDH1A1 P00352 6/20 0.51
NPSR1 Q6W5P4 1/20 0.51
CYP1A2 P05177 6/20 0.50
CYP2D6 P10635 6/20 0.50
CYP3A4 P08684 5/20 0.50
CYP2C19 P33261 5/20 0.50
CLK4 Q9HAZ1 4/20 0.50
ALOX15 P16050 2/20 0.50
LTA4H P09960 1/20 0.50
GSK3B P49841 1/20 0.49
PKM P14618 1/20 0.49
RAD52 P43351 1/20 0.49
HSD17B10 Q99714 4/20 0.48
MAPK1 P28482 1/20 0.48
LMNA P02545 1/20 0.46
TSHR P16473 1/20 0.46

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
SCHEMBL22792313 0.89 L3MBTL1 (0.50) POLBL3MBTL1MEN1KMT2AALDH1A1
SCHEMBL22792331 0.85 CYP1A2 (0.50) POLBL3MBTL1MEN1KMT2AALDH1A1
SCHEMBL22792619 0.79 ALDH1A1 (0.52) POLBL3MBTL1MEN1KMT2AALDH1A1
SCHEMBL1678795 0.79 LTA4H (0.53) POLBL3MBTL1MEN1KMT2AALDH1A1
SCHEMBL22792060 0.79 LTA4H (0.53) POLBL3MBTL1MEN1KMT2AALDH1A1
SCHEMBL22792284 0.79 LTA4H (0.53) POLBL3MBTL1MEN1KMT2AALDH1A1
SCHEMBL13101037 0.79 MEN1 (0.58) POLBL3MBTL1MEN1KMT2AALDH1A1
SCHEMBL22792616 0.78 MEN1 (0.51) POLBL3MBTL1MEN1KMT2AALDH1A1
SCHEMBL22792621 0.78 CYP1A2 (0.54) POLBL3MBTL1MEN1KMT2AALDH1A1
SCHEMBL22792288 0.78 ALDH1A1 (0.51) POLBL3MBTL1MEN1KMT2AALDH1A1

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-2020252229-A2 INHIBITORS OF SARM1 DISARM THERAPEUTICS, INC. (US) 2020-12-17 WO disclosed