Perchlorate

Perchlorate

SCHEMBL8087283

O=c1c2ccccc2nnn1O[O+]=C(N=C1CCCC1)N=C1CCCC1.[O-][Cl+3]([O-])([O-])[O-]

nearest known ligand 0.38

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Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
HPSE Q9Y251 1/20 0.38
ALDH1A1 P00352 7/20 0.35
HPGD P15428 2/20 0.35
MAPK1 P28482 1/20 0.35
SMN1; SMN2 Q16637 4/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C19 P33261 1/20 0.34
RAB9A P51151 2/20 0.34
NPC1 O15118 1/20 0.34
HTT P42858 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33

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
Perchlorate SCHEMBL8086953 0.99 MEN1 (0.38) MEN1KMT2AHPSEALDH1A1HPGD
Hydrochloric Acid SCHEMBL8099458 0.94 HPSE (0.39) MEN1KMT2AHPSEALDH1A1HPGD
Perchlorate SCHEMBL8094355 0.72 GAA (0.35) MEN1KMT2AALDH1A1HPGDCYP1A2
Perchlorate SCHEMBL8086092 0.71 GAA (0.34) MEN1KMT2AALDH1A1HPGDCYP1A2
Hydrochloric Acid SCHEMBL8100111 0.69 ALDH1A1 (0.43) MEN1KMT2AHPSEALDH1A1HPGD
Perchlorate SCHEMBL8095830 0.68
SCHEMBL6234424 0.67 HPSE (0.52) MEN1KMT2AHPSEALDH1A1HPGD
Perchlorate SCHEMBL8087739 0.67
SCHEMBL1561845 0.65 HPSE (0.53) MEN1KMT2AHPSEALDH1A1HPGD
SCHEMBL18493192 0.65 HPSE (0.50) MEN1KMT2AHPSEALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1061904-A1 NANOPARTICLES, METHOD FOR PRODUCING NANOPARTICLES AND USE OF THE SAME Aventis Research & Technologies GmbH & Co KG (DE) 2000-12-27 EP disclosed
WO-1999047130-A1 NANOPARTICLES, METHOD FOR PRODUCING NANOPARTICLES AND USE OF THE SAME AVENTIS RESEARCH & TECHNOLOGIES GMBH & CO. KG (DE) 1999-09-23 WO disclosed