SCHEMBL23708441

SCHEMBL23708441

NCc1ccc(N2CCCC2)c(C(N)=O)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.65
HSD17B10 Q99714 3/20 0.65
MEN1 O00255 3/20 0.65
KMT2A Q03164 3/20 0.65
MAPT P10636 2/20 0.65
GFER P55789 2/20 0.65
THRB P10828 1/20 0.65
ALOX15 P16050 1/20 0.65
YWHAG P61981 1/20 0.65
HTT P42858 2/20 0.63
ALDH1A1 P00352 8/20 0.56
SMN1; SMN2 Q16637 3/20 0.56
NPC1 O15118 1/20 0.55
CSF1R P07333 1/20 0.47
GAA P10253 5/20 0.46
CDC7 O00311 2/20 0.46
CDK9 P50750 1/20 0.46
L3MBTL1 Q9Y468 3/20 0.43
PKM P14618 1/20 0.43
LMNA P02545 1/20 0.41

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
SCHEMBL3087577 0.86 HTT (0.66) KDM4EHSD17B10MEN1KMT2AMAPT
SCHEMBL17113198 0.82 KDM4E (0.56) KDM4EHSD17B10MEN1KMT2AMAPT
SCHEMBL3086566 0.79 HTT (0.57) KDM4EHSD17B10MEN1KMT2AMAPT
SCHEMBL17774819 0.79 KDM4E (1.00) KDM4EHSD17B10MEN1KMT2AMAPT
SCHEMBL3081902 0.78 HTT (0.56) KDM4EHSD17B10MEN1KMT2AMAPT
SCHEMBL17774829 0.78 HTT (1.00) KDM4EHSD17B10MEN1KMT2AMAPT
SCHEMBL12505443 0.78 KDM4E (0.69) KDM4EHSD17B10MEN1KMT2AMAPT
SCHEMBL28325509 0.78 HTT (0.71) KDM4EHSD17B10MEN1KMT2AMAPT
SCHEMBL23708151 0.78 KDM4E (0.69) KDM4EHSD17B10MEN1KMT2AMAPT
SCHEMBL3089872 0.77 CSF1R (0.55) KDM4EHSD17B10MEN1KMT2AMAPT

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-2021154966-A1 COMPOUNDS AND COMPOSITIONS FOR USE IN TREATING SKIN DISORDERS KAMARI PHARMA LTD. (IL) 2021-08-05 WO disclosed