Hypochlorous Acid

Hypochlorous Acid

SCHEMBL21486116

O=c1oc2nc(N3CCCNCC3)ccc2cc1-c1cn2cccnc2n1.OCl

nearest known ligand 0.52

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.52
KDM4E B2RXH2 8/20 0.52
RAB9A P51151 6/20 0.52
HPGD P15428 6/20 0.52
NPC1 O15118 5/20 0.52
GAA P10253 4/20 0.52
HSD17B10 Q99714 4/20 0.52
MAPT P10636 3/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
MEN1 O00255 1/20 0.52
TP53 P04637 1/20 0.52
TSHR P16473 1/20 0.52
KMT2A Q03164 1/20 0.52
SUV39H2 Q9H5I1 5/20 0.39
PRKCQ Q04759 3/20 0.38
PRKCA P17252 1/20 0.36
PRKCD Q05655 1/20 0.36
LMNA P02545 1/20 0.35
PKM P14618 1/20 0.35
GLA P06280 4/20 0.35

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
SCHEMBL15230572 0.97 ALDH1A1 (0.55) ALDH1A1KDM4ERAB9AHPGDNPC1
Hydrochloric Acid SCHEMBL15230055 0.97 ALDH1A1 (0.54) ALDH1A1KDM4ERAB9AHPGDNPC1
Hypochlorous Acid SCHEMBL21486045 0.97 ALDH1A1 (0.56) ALDH1A1KDM4ERAB9AHPGDNPC1
SCHEMBL16782265 0.94 ALDH1A1 (0.59) ALDH1A1KDM4ERAB9AHPGDNPC1
Hydrochloric Acid SCHEMBL15230482 0.93 ALDH1A1 (0.58) ALDH1A1KDM4ERAB9AHPGDNPC1
Hypochlorous Acid SCHEMBL21486014 0.86 ALDH1A1 (0.52) ALDH1A1KDM4ERAB9AHPGDNPC1
Hypochlorous Acid SCHEMBL21486119 0.85 ALDH1A1 (0.41) ALDH1A1KDM4ERAB9AHPGDNPC1
Hypochlorous Acid SCHEMBL21486107 0.84 ALDH1A1 (0.40) ALDH1A1KDM4ERAB9AHPGDNPC1
SCHEMBL15229874 0.83 ALDH1A1 (0.52) ALDH1A1KDM4ERAB9AHPGDNPC1
SCHEMBL16782210 0.83 ALDH1A1 (0.54) ALDH1A1KDM4ERAB9AHPGDNPC1

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