Hypochlorous Acid

Hypochlorous Acid

SCHEMBL6563538

Cc1cc(C)nc(C)c1.OCl

nearest known ligand 0.55

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOS3 P29474 2/20 0.55
NOS2 P35228 2/20 0.55
NOS1 P29475 1/20 0.55
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
POLB P06746 2/20 0.39
APOBEC3G Q9HC16 1/20 0.39
LCK P06239 1/20 0.38
ALDH1A1 P00352 5/20 0.38
MAPK1 P28482 4/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
LMNA P02545 3/20 0.38
MAPT P10636 2/20 0.38
UHRF1 Q96T88 1/20 0.38
APAF1 O14727 1/20 0.37
HPGD P15428 1/20 0.37
ALOX15 P16050 1/20 0.37
HK1 P19367 1/20 0.37
CASP1 P29466 1/20 0.37
MPI P34949 1/20 0.37

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
SCHEMBL1050198 0.90 NOS3 (0.63) NOS3NOS2NOS1MEN1KMT2A
SCHEMBL7489 0.90
SCHEMBL9472907 0.90 NOS3 (0.63) NOS3NOS2NOS1MEN1KMT2A
Bromide SCHEMBL10623440 0.87 NOS3 (0.60) NOS3NOS2NOS1MEN1KMT2A
Iodide SCHEMBL20816339 0.87 NOS3 (0.60) NOS3NOS2NOS1MEN1KMT2A
Hydrogen Sulfide SCHEMBL5051773 0.87 NOS3 (0.60) NOS3NOS2NOS1MEN1KMT2A
Fluoride SCHEMBL893225 0.87 NOS3 (0.60) NOS3NOS2NOS1MEN1KMT2A
SCHEMBL487353 0.87 NOS3 (0.60) NOS3NOS2NOS1MEN1KMT2A
SCHEMBL19816355 0.87 NOS3 (0.60) NOS3NOS2NOS1MEN1KMT2A
Hydrochloric Acid SCHEMBL458427 0.87 NOS3 (0.60) NOS3NOS2NOS1MEN1KMT2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1033368-B1 Fluorinated triazinic compounds SOLVAY SOLEXIS SPA (IT) 2004-07-14 EP disclosed
US-6313291-B1 OIL REPELLENT TEXTILES THAT EXHIBIT WASHFASTNESS AND SOLVENT RESISTANCE AUSIMONT S.P.A. (IT) 2001-11-06 US disclosed
EP-1033368-A2 Fluorinated triazinic compounds Ausimont S.p.A. (IT) 2000-09-06 EP disclosed