SCHEMBL12335463

SCHEMBL12335463

Nc1ccc(NS(=O)(=O)c2ccccc2-c2ccccc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KEAP1 Q14145 1/20 0.60
▸ KMT2A Q03164 4/20 0.56
▸ ALOX5AP P20292 2/20 0.50
▸ FEN1 P39748 2/20 0.50
▸ MEN1 O00255 3/20 0.49
▸ EDNRB P24530 4/20 0.48
▸ EDNRA P25101 4/20 0.48
▸ CA1 P00915 1/20 0.46
▸ CA2 P00918 1/20 0.46
▸ HTT P42858 1/20 0.46
▸ CA9 Q16790 1/20 0.46
▸ ALDH1A1 P00352 2/20 0.45
▸ CYP1A2 P05177 1/20 0.45
▸ CYP3A4 P08684 1/20 0.45
▸ MAPT P10636 1/20 0.45
▸ CYP2C19 P33261 1/20 0.45
▸ CASP1 P29466 1/20 0.44
▸ POLB P06746 1/20 0.44
▸ PKM P14618 1/20 0.43
▸ PGR P06401 1/20 0.43

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
SCHEMBL8350452 0.88 EDNRA (0.54) KEAP1KMT2AALOX5APFEN1MEN1
SCHEMBL12336164 0.84 EDNRA (0.51) KMT2AALOX5APFEN1MEN1EDNRB
SCHEMBL27575420 0.83 KMT2A (0.54) KEAP1KMT2AALOX5APFEN1MEN1
SCHEMBL14940241 0.80 KEAP1 (0.62) KEAP1KMT2AMEN1CA1CA2
SCHEMBL30737530 0.77 POLB (0.60) KEAP1KMT2AMEN1EDNRBEDNRA
SCHEMBL3653048 0.77 KEAP1 (0.59) KEAP1KMT2AMEN1EDNRACA1
SCHEMBL29118833 0.77 PGR (0.65) KEAP1KMT2AMEN1ALDH1A1MAPT
SCHEMBL29118847 0.77 ALDH1A1 (0.65) KEAP1KMT2AMEN1CA1CA2
SCHEMBL19603196 0.76 KEAP1 (0.58) KEAP1KMT2AMEN1EDNRACA1
SCHEMBL3081180 0.75 KEAP1 (1.00) KEAP1KMT2AMEN1CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150353538-A1 COMPOUNDS AND THERAPEUTIC USES THEREOF ALZHEIMER'S INSTITUTE OF AMERICA, INC. (US) 2015-12-10 — — US disclosed
WO-2011109441-A1 COMPOUNDS AND THERAPEUTIC USES THEREOF MYREXIS, INC. (US) 2011-09-09 — — 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 (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-20150353538-A1 COMPOUNDS AND THERAPEUTIC USES THEREOF NFATC1, CD47, CD4 KEAP1 1375/4885KMT2A 3000/4885ALOX5AP 329/4885

“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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