Hypochlorous Acid

Hypochlorous Acid

SCHEMBL21486121

O=c1oc2nc(N3CCNCC3)ccc2cc1-c1cn2ccccc2n1.OCl

nearest known ligand 0.55

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.55
NPC1 O15118 7/20 0.55
RAB9A P51151 7/20 0.55
MAPT P10636 5/20 0.55
LMNA P02545 1/20 0.55
PKM P14618 1/20 0.55
POLB P06746 3/20 0.42
NFKB1 P19838 1/20 0.42
NFKB2 Q00653 1/20 0.42
RELA Q04206 1/20 0.42
KDM4E B2RXH2 6/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
HSD17B10 Q99714 3/20 0.39
KMT2A Q03164 2/20 0.39
HPGD P15428 2/20 0.39
MEN1 O00255 1/20 0.39
TP53 P04637 1/20 0.39
GAA P10253 1/20 0.39
TSHR P16473 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL15230288 0.97 ALDH1A1 (0.58) ALDH1A1NPC1RAB9AMAPTLMNA
Hypochlorous Acid SCHEMBL21486014 0.96 ALDH1A1 (0.52) ALDH1A1NPC1RAB9AMAPTLMNA
Hydrochloric Acid SCHEMBL15230367 0.96 ALDH1A1 (0.57) ALDH1A1NPC1RAB9AMAPTLMNA
SCHEMBL16782210 0.94 ALDH1A1 (0.54) ALDH1A1NPC1RAB9AMAPTLMNA
Hydrochloric Acid SCHEMBL15230411 0.93 ALDH1A1 (0.53) ALDH1A1NPC1RAB9AMAPTLMNA
Hypochlorous Acid SCHEMBL21485963 0.88 NPC1 (0.50) ALDH1A1NPC1RAB9AMAPTLMNA
Hypochlorous Acid SCHEMBL21486020 0.88 NPC1 (0.50) ALDH1A1NPC1RAB9AMAPTLMNA
Hypochlorous Acid SCHEMBL21486034 0.87 RAB9A (0.55) ALDH1A1NPC1RAB9AMAPTLMNA
Hypochlorous Acid SCHEMBL21485982 0.87 NPC1 (0.44) ALDH1A1NPC1RAB9AMAPTLMNA
SCHEMBL15230883 0.86 NPC1 (0.46) ALDH1A1NPC1RAB9AMAPTLMNA

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-2819519-B1 COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY PTC THERAPEUTICS INC (US) 2019-10-23 EP claimed