Perchlorate

Perchlorate

SCHEMBL268534

CSc1n(C)c2ccccc2[n+]1C.[O-][Cl+3]([O-])([O-])[O-]

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERAP1 Q9NZ08 1/20 0.42
KDM4E B2RXH2 4/20 0.41
MAPT P10636 3/20 0.41
ALDH1A1 P00352 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
LMNA P02545 4/20 0.41
RAB9A P51151 4/20 0.40
HTT P42858 2/20 0.40
PTPN1 P18031 1/20 0.39
POLB P06746 2/20 0.37
KMT2A Q03164 4/20 0.33
MEN1 O00255 3/20 0.33
NPC1 O15118 2/20 0.33
PKM P14618 2/20 0.33
MAPK1 P28482 2/20 0.33
RCE1 Q9Y256 1/20 0.32
GPR3 P46089 1/20 0.31
APAF1 O14727 1/20 0.31
PABPC1 P11940 1/20 0.31
MMP14 P50281 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
SCHEMBL4583682 0.93 ERAP1 (0.46) ERAP1KDM4EMAPTALDH1A1L3MBTL1
Iodide SCHEMBL30669499 0.91 ERAP1 (0.45) ERAP1KDM4EMAPTALDH1A1L3MBTL1
Perchlorate SCHEMBL269183 0.73 ERAP1 (0.42) ERAP1KDM4EMAPTALDH1A1L3MBTL1
Perchlorate SCHEMBL269605 0.70 ERAP1 (0.39) ERAP1KDM4EMAPTALDH1A1L3MBTL1
Perchlorate SCHEMBL268972 0.69 ERAP1 (0.38) ERAP1KDM4EMAPTALDH1A1L3MBTL1
SCHEMBL1049324 0.69 ERAP1 (0.50) ERAP1KDM4EMAPTALDH1A1L3MBTL1
SCHEMBL23641666 0.67 ERAP1 (0.49) ERAP1KDM4EMAPTALDH1A1L3MBTL1
Iodide SCHEMBL9134481 0.67 PTPN1 (0.50) ERAP1KDM4EMAPTALDH1A1L3MBTL1
Water SCHEMBL21823213 0.67 ERAP1 (0.49) ERAP1KDM4EMAPTALDH1A1L3MBTL1
Bromide SCHEMBL5145384 0.66 ERAP1 (0.47) ERAP1KDM4EMAPTALDH1A1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9118019-B2 Heterocyclic radical or diradical, the dimers, oligomers, polymers, dispiro compounds and polycycles thereof, the use thereof, organic semiconductive material and electronic or optoelectronic component NOVALED AG (DE) 2015-08-25 US disclosed
US-20120146012-A1 Heterocyclic Radical or Diradical, The Dimers, Oligomers, Polymers, Dispiro Compounds and Polycycles Thereof, the Use Thereof, Organic Semiconductive Material and Electronic or Optoelectronic Component NOVALED AG (DE) 2012-06-14 US disclosed
US-8134146-B2 Heterocyclic radical or diradical, the dimers, oligomers, polymers, dispiro compounds and polycycles thereof, the use thereof, organic semiconductive material and electronic or optoelectronic component NOVALED AG (DE) 2012-03-13 US disclosed
US-20070252140-A1 Heterocyclic Radical or Diradical, the Dimers, Oligomers, Polymers, Dispiro Compounds and Polycycles Thereof, the Use Thereof, Organic Semiconductive Material and Electronic or Optoelectronic Component NOVALED AG (DE) 2007-11-01 US disclosed
EP-1837926-A1 Heterocyclic radicals or diradicals and their dimers, oligomers, polymers, di-spiro and polycyclic derivatives as well as their use in organic semiconductor materials and electronic devices. Novaled AG (DE) 2007-09-26 EP disclosed
US-5405968-A Useful as drugs, for producing singlet oxygen, sensitizers in electrophotographic layers and for photopolymerizations and as laser light sensitive dyes in optical recording media BASF AKTIENGESELLSCHAFT (DE) 1995-04-11 US disclosed
EP-0579638-B1 POLYKETOMETHINE DYES BASF AG (DE) 1994-10-26 EP disclosed
EP-0579638-A1 POLYKETOMETHINE DYES. BASF AG (DE) 1994-01-26 EP disclosed
WO-1992017549-A2 POLYKETOMETHINE DYES BASF AKTIENGESELLSCHAFT (DE) 1992-10-15 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120146012-A1 Heterocyclic Radical or Diradical, The Dimers, Oligomers, Polymers, Dispiro Compounds and Polycycles Thereof, the Use Thereof, Organic Semiconductive Material and Electronic or Optoelectronic Component PPOX, SCO2, CCNO ERAP1 4864/4885KDM4E 4796/4885MAPT 1283/4885
US-20070252140-A1 Heterocyclic Radical or Diradical, the Dimers, Oligomers, Polymers, Dispiro Compounds and Polycycles Thereof, the Use Thereof, Organic Semiconductive Material and Electronic or Optoelectronic Component PPOX, SCO2, CCNO ERAP1 4864/4885KDM4E 4802/4885MAPT 1268/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.