Perchlorate

Perchlorate

SCHEMBL9003577

COC(=O)C(C(=O)OC)=C(C[S+](c1ccc(C(C)(C)C)cc1)c1ccc(C(C)(C)C)cc1)c1ccccc1.[O-][Cl+3]([O-])([O-])[O-]

nearest known ligand 0.42

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESRRG P62508 2/20 0.42
KCNK9 Q9NPC2 1/20 0.40
RAB9A P51151 5/20 0.40
NPC1 O15118 2/20 0.40
POLB P06746 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
MAPT P10636 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
CASP3 P42574 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
LMNA P02545 3/20 0.39
MAPK1 P28482 2/20 0.37
ALDH1A1 P00352 3/20 0.36
ALOX15 P16050 1/20 0.36
APEX1 P27695 1/20 0.36
RECQL P46063 1/20 0.36
HSD17B10 Q99714 1/20 0.36
TNF P01375 1/20 0.36
KLF5 Q13887 1/20 0.36
NOD1 Q9Y239 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
SCHEMBL9003719 0.83 TSHR (0.43) NPC1POLBTDP1MAPTLMNA
Perchlorate SCHEMBL9003401 0.80 TDP1 (0.39) ESRRGKCNK9RAB9ANPC1POLB
SCHEMBL9003734 0.80 RAB9A (0.35) ESRRGKCNK9RAB9ANPC1POLB
SCHEMBL9003589 0.76 ALDH1A1 (0.40) ESRRGKCNK9RAB9ANPC1POLB
SCHEMBL9003615 0.75 RAB9A (0.50) ESRRGKCNK9RAB9ANPC1POLB
SCHEMBL9003411 0.74 TDP1 (0.36) ESRRGKCNK9RAB9ANPC1POLB
SCHEMBL9003470 0.70 ESRRB (0.33) RAB9ANPC1POLBLMNAALDH1A1
SCHEMBL27941245 0.68 TSHR (0.48) TDP1MAPTMAPK1ALOX15KMT2A
SCHEMBL27952638 0.66 CES2 (0.49) L3MBTL1LMNAKMT2ASMN1; SMN2KDM4E
Perchlorate SCHEMBL9003671 0.65 TDP1 (0.47) RAB9ANPC1POLBTDP1MAPT

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