SCHEMBL12913016

SCHEMBL12913016

C=CCOc1nn(S(=O)(=O)c2ccccc2)c2ccccc12

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ SLC9A1 P19634 1/20 0.40
▸ MAPT P10636 1/20 0.38
▸ ATM Q13315 1/20 0.38
▸ HTR6 P50406 9/20 0.36
▸ CNR1 P21554 1/20 0.36
▸ ACHE P22303 1/20 0.36
▸ CNR2 P34972 1/20 0.36
▸ IDE P14735 1/20 0.36
▸ CA12 O43570 1/20 0.35
▸ CA1 P00915 1/20 0.35
▸ CA2 P00918 1/20 0.35
▸ CA7 P43166 1/20 0.35
▸ CA9 Q16790 1/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ MET P08581 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.34

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
SCHEMBL12913014 0.72 CNR2 (0.70) MAPTATMCNR1ACHECNR2
SCHEMBL12912991 0.70 CYP3A4 (0.41) ACHE
SCHEMBL12913013 0.69 CNR2 (0.45) MAPTATMCNR1ACHECNR2
SCHEMBL7808408 0.69 CNR2 (0.45) MAPTCNR1ACHECNR2MEN1
SCHEMBL30302187 0.69 RORC (0.54) SLC9A1HTR6MEN1KMT2AHTT
SCHEMBL12912994 0.68 BCHE (0.45) CNR1ACHECNR2MEN1KMT2A
SCHEMBL7808406 0.68 MAPT (0.37) MAPTATMCNR1ACHECNR2
SCHEMBL9980554 0.67 SLC9A1 (0.45) SLC9A1HTR6IDEMEN1KMT2A
SCHEMBL7811883 0.67 CNR2 (0.58) CNR1ACHECNR2CA12CA1
SCHEMBL12913017 0.67 CNR2 (0.42) MAPTATMCNR1ACHECNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1776345-B1 Method of preparing N2-functionalised indazolinone derivatives UNIV ST ANDREWS (GB) 2013-02-13 — — EP disclosed
US-7868184-B2 Multicore indazolinone library The University of the University of St. Andrews (GB) 2011-01-11 — — US disclosed
US-7868184-B2 Multicore indazolinone library The University of the University of St. Andrews (GB) 2011-01-11 — — US disclosed
US-20070179294-A1 Multicore indazolinone library THE UNIVERSITY COURT OF THE UNIVERSITY OF ST ANDREWS (GB) 2007-08-02 — — US disclosed
US-20070179294-A1 Multicore indazolinone library THE UNIVERSITY COURT OF THE UNIVERSITY OF ST ANDREWS (GB) 2007-08-02 — — US 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 (1 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-20070179294-A1 Multicore indazolinone library IPMK, TTK, IWS1 SLC9A1 4773/4885MAPT 2038/4885ATM 364/4885

“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.

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