SCHEMBL27290503

SCHEMBL27290503

O=Nc1ccc(C(=O)OCl)cc1N=O

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33
KDM4E B2RXH2 1/20 0.33
GLA P06280 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
CASP1 P29466 1/20 0.33
CASP7 P55210 1/20 0.33
ATM Q13315 1/20 0.33
HSD17B10 Q99714 1/20 0.33
CA12 O43570 3/20 0.32
CA1 P00915 3/20 0.32
CA2 P00918 3/20 0.32
CA7 P43166 3/20 0.32
CA9 Q16790 3/20 0.32
CA14 Q9ULX7 3/20 0.32
XDH P47989 1/20 0.32
PLA2G7 Q13093 1/20 0.32
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30

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
SCHEMBL23731029 0.81 ALDH1A1 (0.34) ALDH1A1KDM4EGLAGAAMAPT
SCHEMBL27289934 0.77 CA12 (0.30) CA12CA1CA2CA7CA9
SCHEMBL14314154 0.75 TSHR (0.48) ALDH1A1KDM4EGAAMAPTCA12
SCHEMBL19441520 0.74 LCK (0.44) ALDH1A1KDM4EMAPTHSD17B10CA1
SCHEMBL14707992 0.74 HDAC3 (0.47)
SCHEMBL3171176 0.73 CA1 (0.44) ALDH1A1MAPTCA12CA1CA2
SCHEMBL6061451 0.70 ATM (0.46) ALDH1A1KDM4EMAPTATMCA12
SCHEMBL1479648 0.69 ALDH1A1 (0.51) ALDH1A1KDM4EGLAGAAMAPT
SCHEMBL13265529 0.69 ALDH1A1 (0.55) ALDH1A1KDM4EGLAGAAMAPT
SCHEMBL27973172 0.68 KMT2A (0.50) ALDH1A1GAAMAPTHPGDNPC1

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-2024075968-A1 SKIN-IMPROVING COMPOSITION FOR EXTERNAL APPLICATION TO SKIN 주식회사 엑티브온 2024-04-11 WO disclosed