Perchlorate

Perchlorate

SCHEMBL8095660

CN(C)C(=[O+]ON1C(=O)c2ccccc2C1=O)N(C)C.[O-][Cl+3]([O-])([O-])[O-]

nearest known ligand 0.41

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Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
VDR P11473 2/20 0.41
KMT2A Q03164 4/20 0.38
MEN1 O00255 2/20 0.38
ALDH1A1 P00352 8/20 0.38
KDM4E B2RXH2 6/20 0.38
MAPT P10636 4/20 0.38
F2 P00734 2/20 0.38
HPGD P15428 4/20 0.37
GAA P10253 1/20 0.36
CYP1A2 P05177 3/20 0.35
CYP2C9 P11712 1/20 0.35
HTT P42858 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
CYP3A4 P08684 1/20 0.33
XBP1 P17861 1/20 0.33
CYP2C19 P33261 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
LMNA P02545 1/20 0.33
POLB P06746 1/20 0.32

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
Hydrochloric Acid SCHEMBL8102289 0.92 VDR (0.41) VDRKMT2AMEN1ALDH1A1KDM4E
SCHEMBL8100119 0.88 KMT2A (0.38) VDRKMT2AMEN1ALDH1A1KDM4E
Perchlorate SCHEMBL8094355 0.71 GAA (0.35) VDRKMT2AMEN1ALDH1A1KDM4E
Perchlorate SCHEMBL8086092 0.70 GAA (0.34) VDRKMT2AMEN1ALDH1A1KDM4E
SCHEMBL2828593 0.67 GAA (0.42) VDRKMT2AMEN1ALDH1A1KDM4E
SCHEMBL859822 0.64 ALDH1A1 (0.47) VDRKMT2AMEN1ALDH1A1KDM4E
SCHEMBL29838651 0.64 ALDH1A1 (0.47) VDRKMT2AMEN1ALDH1A1KDM4E
SCHEMBL8087971 0.64 ALDH1A1 (0.44) VDRKMT2AMEN1ALDH1A1KDM4E
SCHEMBL8088854 0.64 ALDH1A1 (0.44) VDRKMT2AMEN1ALDH1A1KDM4E
SCHEMBL14697334 0.64 ALDH1A1 (0.59) KMT2AMEN1ALDH1A1MAPTGAA

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