Perchlorate

Perchlorate

SCHEMBL9508583

Oc1c(-c2ccccc2)cc(-[n+]2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)cc1-c1ccccc1.[O-][Cl+3]([O-])([O-])[O-]

nearest known ligand 0.70

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 10/20 0.70
NPC1 O15118 10/20 0.70
NTSR1 P30989 3/20 0.70
HTT P42858 3/20 0.70
MAPK1 P28482 2/20 0.70
NPSR1 Q6W5P4 2/20 0.70
KDM4E B2RXH2 1/20 0.70
UHRF1 Q96T88 1/20 0.70
NR2F2 P24468 1/20 0.69
RAD52 P43351 1/20 0.69
RCE1 Q9Y256 1/20 0.56
KMT2A Q03164 4/20 0.56
MEN1 O00255 3/20 0.56
MAPT P10636 2/20 0.56
LMNA P02545 1/20 0.56
NPY1R P25929 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
CA2 P00918 2/20 0.55
CRHBP P24387 1/20 0.55

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
SCHEMBL9512235 0.95 RAB9A (0.61) RAB9ANPC1NTSR1HTTMAPK1
Hydrochloric Acid SCHEMBL23198666 0.93 NPC1 (0.64) RAB9ANPC1NTSR1HTTMAPK1
SCHEMBL23198667 0.90 RAB9A (0.56) RAB9ANPC1NTSR1HTTMAPK1
Trifluoromethanesulfonic Acid SCHEMBL23198662 0.83 NPC1 (0.50) RAB9ANPC1NTSR1HTTMAPK1
SCHEMBL13698931 0.83 RAB9A (0.49) RAB9ANPC1NTSR1HTTMAPK1
Perchlorate SCHEMBL11536227 0.83 NPC1 (1.00) RAB9ANPC1NTSR1HTTMAPK1
SCHEMBL14164148 0.82 NPC1 (0.51) RAB9ANPC1NTSR1HTTMAPK1
SCHEMBL158977 0.81 NPC1 (0.66) RAB9ANPC1NTSR1HTTMAPK1
SCHEMBL9290152 0.79 NPC1 (0.48) RAB9ANPC1NTSR1HTTMAPK1
SCHEMBL9511289 0.78 NPC1 (0.61) RAB9ANPC1NTSR1HTTMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0226543-B1 PROCESS FOR THE PREPARATION OF GLYCIDYL COMPOUNDS CIBA-GEIGY AG (CH) 1993-09-29 EP claimed
US-4722983-A REACTING A PHENOLIC COMPOUND WITH A HALOHYDRIN IN APROTIC SOLVENT CIBA-GEIGY CORPORATION (US) 1988-02-02 US claimed
EP-0226543-A2 Process for the preparation of glycidyl compounds CIBA-GEIGY AG (CH) 1987-06-24 EP claimed
EP-0226543-B1 PROCESS FOR THE PREPARATION OF GLYCIDYL COMPOUNDS CIBA-GEIGY AG (CH) 1993-09-29 EP disclosed
US-4722983-A REACTING A PHENOLIC COMPOUND WITH A HALOHYDRIN IN APROTIC SOLVENT CIBA-GEIGY CORPORATION (US) 1988-02-02 US disclosed
US-4722983-A REACTING A PHENOLIC COMPOUND WITH A HALOHYDRIN IN APROTIC SOLVENT CIBA-GEIGY CORPORATION (US) 1988-02-02 US disclosed
EP-0226543-A2 Process for the preparation of glycidyl compounds CIBA-GEIGY AG (CH) 1987-06-24 EP disclosed
EP-0226543-A2 Process for the preparation of glycidyl compounds CIBA-GEIGY AG (CH) 1987-06-24 EP disclosed