SCHEMBL29923768

SCHEMBL29923768

CCc1cc(C(=O)NCCN(C)C)c2ncccc2c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 2/20 0.52
AOX1 Q06278 1/20 0.51
KDM4E B2RXH2 3/20 0.49
L3MBTL1 Q9Y468 3/20 0.49
TET3 O43151 1/20 0.49
TET2 Q6N021 1/20 0.49
TET1 Q8NFU7 1/20 0.49
SLC40A1 Q9NP59 2/20 0.47
RAD52 P43351 5/20 0.47
ALDH1A1 P00352 1/20 0.46
HSD17B10 Q99714 1/20 0.46
UHRF1 Q96T88 1/20 0.45
HTT P42858 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
UBE2N P61088 1/20 0.44
TMEM97 Q5BJF2 1/20 0.44
SIGMAR1 Q99720 1/20 0.44
HTR2C P28335 1/20 0.44
MET P08581 1/20 0.43
ALOX5 P09917 1/20 0.43

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
SCHEMBL29923816 0.86 EGLN1 (0.54) EGLN1KDM4EL3MBTL1TET3TET2
SCHEMBL29923470 0.83 EGLN1 (0.51) EGLN1KDM4EL3MBTL1TET3TET2
SCHEMBL24916001 0.81 HTT (0.44) EGLN1AOX1KDM4ESLC40A1RAD52
SCHEMBL29923860 0.81 PARP1 (0.49) EGLN1
SCHEMBL29923738 0.80 KMT2A (0.51) EGLN1KDM4ESMN1; SMN2
SCHEMBL29923336 0.80 EGLN1 (0.52) EGLN1ALDH1A1HTTSMN1; SMN2
SCHEMBL29923702 0.78 EGLN1 (0.46) EGLN1
SCHEMBL7026713 0.77 AOX1 (0.76) AOX1KDM4ERAD52ALDH1A1HSD17B10
SCHEMBL29923352 0.77 EGLN1 (0.45) EGLN1
SCHEMBL29923343 0.77 PARP1 (0.52) EGLN1KDM4EL3MBTL1TET3TET2

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
EP-4055013-A1 WDR5 INHIBITORS AND MODULATORS Vanderbilt University (US) 2022-09-14 EP disclosed