SCHEMBL18711520

SCHEMBL18711520

CC(=O)N1CCN(S(=O)(=O)c2cc(Cl)c(Cl)s2)CC1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.52
▸ KMT2A Q03164 3/20 0.52
▸ ALDH1A1 P00352 2/20 0.51
▸ EPHX2 P34913 1/20 0.51
▸ SPR P35270 1/20 0.43
▸ GAA P10253 1/20 0.41
▸ HSP90AA1 P07900 1/20 0.41
▸ F10 P00742 3/20 0.41
▸ MAPT P10636 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ LPAR1 Q92633 1/20 0.39
▸ LPAR2 Q9HBW0 1/20 0.39
▸ CNR1 P21554 1/20 0.39

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
SCHEMBL18701988 0.85 EPHX2 (0.48) MEN1KMT2AALDH1A1EPHX2SPR
SCHEMBL18711914 0.79 L3MBTL1 (0.61) MEN1KMT2AALDH1A1GAAMAPT
SCHEMBL18711907 0.78 PKM (0.66) MEN1KMT2AALDH1A1EPHX2SPR
SCHEMBL18711451 0.72 KMT2A (0.77) MEN1KMT2AALDH1A1GAAPOLB
SCHEMBL18711517 0.72 PKM (0.73) KMT2AALDH1A1MAPTPOLB
SCHEMBL18711334 0.72 ALDH1A1 (0.75) MEN1KMT2AALDH1A1GAAMAPT
SCHEMBL18711516 0.71 ALDH1A1 (0.62) MEN1KMT2AALDH1A1MAPTCNR1
SCHEMBL18711450 0.71 CNR1 (0.68) MEN1KMT2AALDH1A1MAPTPOLB
SCHEMBL1940087 0.70 HTT (0.46) MEN1KMT2AEPHX2MAPTPOLB
SCHEMBL1939095 0.70 L3MBTL1 (0.51) MEN1KMT2AALDH1A1MAPTPOLB

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-20170096435-A1 SEPIAPTERIN REDUCTASE INHIBITORS MAX-PLANCK-GESELLSCHAFT ZUR FOERDERUNG DER WISSENSCHAFTEN E.V. (DE) 2017-04-06 — — 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-20170096435-A1 SEPIAPTERIN REDUCTASE INHIBITORS SPR, QDPR, SRR MEN1 4876/4885KMT2A 2884/4885ALDH1A1 374/4885

“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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