SCHEMBL6697057

SCHEMBL6697057

CCCc1ccc(S(=O)(=O)Nc2ccsc2CC(=O)N2CCS(O)(O)CC2)cc1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.41
MAPT P10636 2/20 0.41
HPGD P15428 1/20 0.41
KMT2A Q03164 3/20 0.40
MEN1 O00255 1/20 0.40
TSHR P16473 3/20 0.40
GAA P10253 2/20 0.40
MAPK1 P28482 1/20 0.39
POLB P06746 1/20 0.39
METAP2 P50579 1/20 0.39
LMNA P02545 1/20 0.38
FFAR4 Q5NUL3 1/20 0.38
NAMPT P43490 1/20 0.37
ITGB3 P05106 1/20 0.37
ITGA2B P08514 1/20 0.37
KDM4E B2RXH2 1/20 0.37

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
SCHEMBL6697059 0.92 ALDH1A1 (0.41) ALDH1A1MAPTHPGDKMT2AMEN1
SCHEMBL6612972 0.89 HPGD (0.53) ALDH1A1MAPTHPGDKMT2AMEN1
SCHEMBL6624267 0.88 ALDH1A1 (0.43) ALDH1A1MAPTHPGDKMT2AMEN1
SCHEMBL6623939 0.87 TSHR (0.54) ALDH1A1MAPTHPGDKMT2AMEN1
SCHEMBL6625785 0.83 ALDH1A1 (0.41) ALDH1A1MAPTHPGDKMT2AMEN1
SCHEMBL20899670 0.80 ALDH1A1 (0.49) ALDH1A1MAPTHPGDKMT2AMEN1
SCHEMBL3613938 0.79 HSD11B1 (0.50) ALDH1A1MAPTHPGDKMT2AMEN1
SCHEMBL5831433 0.79 ALDH1A1 (0.41) ALDH1A1MAPTHPGDKMT2AMEN1
SCHEMBL5830810 0.78 AKT1 (0.57) ALDH1A1MAPTKMT2AMEN1TSHR
SCHEMBL3253320 0.77 HSD11B1 (0.50) ALDH1A1MAPTHPGDKMT2AMEN1

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
WO-2004112779-A1 NEW USE VII BIOVITRUM AB (SE) 2004-12-29 WO disclosed
US-20030130279-A1 Inhibitors of 11-beta-hydroxy steroid dehydrogenase type 1 BIOVITRUM AB (SE) 2003-07-10 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-20030130279-A1 Inhibitors of 11-beta-hydroxy steroid dehydrogenase type 1 HSD11B1, HSD17B1, HSD3B1 ALDH1A1 47/4885MAPT 3254/4885HPGD 51/4885

“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.