Perchlorate

Perchlorate

SCHEMBL9003262

O=[N+]([O-])c1ccc(C[S+](c2ccccc2)c2cccs2)cc1.[O-][Cl+3]([O-])([O-])[O-].c1cc2ccc1-2

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RCE1 Q9Y256 1/20 0.44
CRHBP P24387 3/20 0.39
CRHR2 Q13324 3/20 0.39
KMT2A Q03164 3/20 0.38
LMNA P02545 3/20 0.38
MAPT P10636 2/20 0.38
ALDH1A1 P00352 2/20 0.38
POLB P06746 1/20 0.38
MAPK1 P28482 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C19 P33261 1/20 0.38
PTPRF P10586 1/20 0.37
PTPN2 P17706 1/20 0.37
PTPN1 P18031 1/20 0.37
PTPN11 Q06124 1/20 0.37
RAB9A P51151 1/20 0.36
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36

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
SCHEMBL9003794 0.79 CYP2C19 (0.53) CRHBPCRHR2KMT2ALMNAMAPT
Perchlorate SCHEMBL9003254 0.74 MEN1 (0.43) RCE1CRHBPCRHR2KMT2ALMNA
SCHEMBL10681251 0.74 CYP2C19 (0.47) RCE1CRHBPCRHR2KMT2ALMNA
SCHEMBL25187033 0.66 MAPK1 (0.74) CRHBPCRHR2KMT2ALMNAMAPT
SCHEMBL167524 0.66 MAPK1 (0.74) CRHBPCRHR2KMT2ALMNAMAPT
SCHEMBL9003797 0.64 CYP2C19 (0.34) CRHBPCRHR2KMT2AALDH1A1CYP1A2
Ammonia Solution, Strong SCHEMBL9570816 0.64 MAPK1 (0.71) RCE1CRHBPCRHR2KMT2ALMNA
Water SCHEMBL4868802 0.64 MAPK1 (0.71) CRHBPCRHR2KMT2ALMNAMAPT
Water SCHEMBL28196816 0.64 MAPK1 (0.71) CRHBPCRHR2KMT2ALMNAMAPT
SCHEMBL28375748 0.64 MAPK1 (0.71) RCE1CRHBPCRHR2KMT2ALMNA

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
US-5500453-A INITIATOR FOR PHOTOSENSITIVE FREE RADICAL CURING/ POLYMERIZATION OF UNSATURATED COMPOUNDS TOYO INK MANUFACTURING CO., LTD. (JP) 1996-03-19 US disclosed