SCHEMBL2104381

SCHEMBL2104381

[CH2]S(=O)(=O)N1CCN(c2ccccn2)CC1

nearest known ligand 0.69

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.69
ALDH1A1 P00352 5/20 0.69
MAPT P10636 1/20 0.69
HSD17B10 Q99714 4/20 0.62
LMNA P02545 1/20 0.61
L3MBTL1 Q9Y468 2/20 0.59
POLB P06746 1/20 0.56
CYP1A2 P05177 1/20 0.55
CYP2D6 P10635 1/20 0.55
TSHR P16473 1/20 0.55
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
USP30 Q70CQ3 1/20 0.53

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
SCHEMBL5500182 0.85 KDM4E (0.71) KDM4EALDH1A1MAPTHSD17B10LMNA
SCHEMBL2104383 0.83 ALDH1A1 (0.76) KDM4EALDH1A1MAPTHSD17B10LMNA
SCHEMBL29857922 0.82 PLD1 (0.73) KDM4EALDH1A1MAPTHSD17B10POLB
SCHEMBL21353591 0.82
SCHEMBL15800694 0.82 PLD1 (0.73) KDM4EALDH1A1MAPTHSD17B10POLB
SCHEMBL4324132 0.81 KDM4E (0.79) KDM4EALDH1A1MAPTHSD17B10LMNA
SCHEMBL13149496 0.80 KDM4E (0.68) KDM4EALDH1A1MAPTHSD17B10LMNA
SCHEMBL2963306 0.77 ALDH1A1 (0.68) KDM4EALDH1A1MAPTHSD17B10LMNA
SCHEMBL1371533 0.77 PLD1 (0.61) KDM4EALDH1A1MAPTHSD17B10POLB
SCHEMBL5251477 0.76 KDM4E (0.76) KDM4EALDH1A1MAPTHSD17B10LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1819667-B1 SULFONAMIDE COMPOUNDS AS CYSTEINE PROTEASE INHIBITORS VIROBAY INC (US) 2012-10-17 EP disclosed
US-8163735-B2 Sulfonamide compounds as cysteine protease inhibitors VIROBAY, INC. (US) 2012-04-24 US disclosed
US-20090233909-A1 Sulfonamide compounds as cysteine protease inhibitors VIROBAY, INC. (US) 2009-09-17 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-20090233909-A1 Sulfonamide compounds as cysteine protease inhibitors CTSF, CTSS, CSTB KDM4E 2963/4885ALDH1A1 2409/4885MAPT 4402/4885

“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.