SCHEMBL1287277

SCHEMBL1287277

CC1(C)OCC(NS(=O)(=O)c2ccc(Cl)s2)CO1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.59
KMT2A Q03164 2/20 0.59
GAA P10253 1/20 0.59
HPGD P15428 1/20 0.59
HTT P42858 1/20 0.59
PSEN1 P49768 11/20 0.50
PSEN2 P49810 11/20 0.50
APH1B Q8WW43 11/20 0.50
NCSTN Q92542 11/20 0.50
APH1A Q96BI3 11/20 0.50
PSENEN Q9NZ42 11/20 0.50
MAPT P10636 3/20 0.44
TDP1 Q9NUW8 1/20 0.44
HTR1A P08908 1/20 0.42
DRD2 P14416 1/20 0.42
HTR7 P34969 1/20 0.42
HTR6 P50406 1/20 0.42

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
SCHEMBL1287442 0.75 HTT (0.48) ALDH1A1KMT2AHTTPSEN1PSEN2
SCHEMBL27900246 0.69 ALDH1A1 (0.59) ALDH1A1KMT2AGAAHPGDHTT
SCHEMBL12228299 0.68 KMT2A (0.54) ALDH1A1KMT2AGAAHPGDHTT
SCHEMBL24254279 0.68 KMT2A (0.56) ALDH1A1KMT2AGAAHPGDHTT
SCHEMBL5074436 0.67 PSEN1 (1.00) ALDH1A1KMT2AGAAHPGDHTT
SCHEMBL14207992 0.67 PSEN1 (0.72) ALDH1A1KMT2AGAAHPGDHTT
SCHEMBL682128 0.66 MAPT (0.63) ALDH1A1KMT2AGAAHPGDHTT
SCHEMBL15396075 0.66 CA2 (0.37)
SCHEMBL4491616 0.66 KMT2A (0.54) ALDH1A1KMT2AGAAHPGDHTT
SCHEMBL3808332 0.66 USP30 (0.60) ALDH1A1KMT2AGAAHPGDHTT

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-20130310384-A1 Sulfonamide-Containing Compounds THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2013-11-21 US disclosed
WO-2012047926-A2 SULFONAMIDE-CONTAINING COMPOUNDS THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2012-04-12 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-20130310384-A1 Sulfonamide-Containing Compounds BACE1, BACE2, GSAP ALDH1A1 3025/4885KMT2A 1318/4885GAA 152/4885

“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.