Perchlorate

Perchlorate

SCHEMBL8086092

O=C1c2ccccc2C(=O)N1O[O+]=C(N=C1CCCCC1)N=C1CCCCC1.[O-][Cl+3]([O-])([O-])[O-]

nearest known ligand 0.34

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.34
ALDH1A1 P00352 9/20 0.33
KDM4E B2RXH2 6/20 0.33
HPGD P15428 3/20 0.33
MAPT P10636 3/20 0.31
CYP1A2 P05177 2/20 0.31
VDR P11473 2/20 0.31
F2 P00734 1/20 0.31
KMT2A Q03164 3/20 0.31
MEN1 O00255 2/20 0.31
CYP2C9 P11712 1/20 0.31

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 SCHEMBL8094355 0.99 GAA (0.35) GAAALDH1A1KDM4EHPGDMAPT
Hydrochloric Acid SCHEMBL8095522 0.93 GAA (0.36) GAAALDH1A1KDM4EHPGDMAPT
Hydrochloric Acid SCHEMBL8095270 0.92 GAA (0.37) GAAALDH1A1KDM4EHPGDMAPT
SCHEMBL8099998 0.88 GAA (0.35) GAAALDH1A1KDM4EHPGDMAPT
Perchlorate SCHEMBL8087739 0.81
Perchlorate SCHEMBL8095830 0.80
Hydrochloric Acid SCHEMBL8096632 0.73 GAA (0.32) GAA
Perchlorate SCHEMBL8086953 0.72 MEN1 (0.38) ALDH1A1HPGDCYP1A2KMT2AMEN1
Hydrochloric Acid SCHEMBL8087205 0.71
Perchlorate SCHEMBL8087283 0.71 MEN1 (0.38) ALDH1A1HPGDCYP1A2KMT2AMEN1

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