SCHEMBL6624174

SCHEMBL6624174

O=C(Cc1cscc1NS(=O)(=O)c1ccc(-c2ccco2)cc1)N1CCOCC1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 3/20 0.41
ALDH1A1 P00352 3/20 0.40
PKM P14618 1/20 0.40
CYP1A2 P05177 1/20 0.40
RAB9A P51151 1/20 0.40
TRIM24 O15164 3/20 0.40
KMT2A Q03164 2/20 0.39
MAPK1 P28482 1/20 0.39
NPC1 O15118 1/20 0.39
LMNA P02545 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
CCKBR P32239 1/20 0.37
POLB P06746 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
HTT P42858 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
SCHEMBL6613171 0.88 MAPT (0.53) ALDH1A1RAB9AKMT2AMAPK1LMNA
SCHEMBL6626941 0.85 ALDH1A1 (0.42) ALDH1A1KMT2AMAPK1LMNAGAA
SCHEMBL6624850 0.85 HSD11B1 (0.45) ALDH1A1RAB9AKMT2AMAPK1NPC1
SCHEMBL6623941 0.84 ALDH1A1 (0.41) GHSRALDH1A1KMT2AMAPK1LMNA
SCHEMBL6624511 0.83 HDAC1 (0.44) GHSRALDH1A1RAB9AKMT2AMAPK1
SCHEMBL6625995 0.83 GHSR (0.41) GHSRALDH1A1PKMCYP1A2RAB9A
SCHEMBL6625797 0.83 HSD11B1 (0.44) GHSRALDH1A1TRIM24KMT2AMAPK1
SCHEMBL6627742 0.82 ALDH1A1 (0.55) ALDH1A1KMT2AMAPK1LMNAGAA
SCHEMBL3620971 0.82 HSD11B1 (0.58) ALDH1A1PKMCYP1A2RAB9AKMT2A
SCHEMBL6686870 0.81 ALDH1A1 (0.43) ALDH1A1KMT2AMAPK1LMNAGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004112779-A1 NEW USE VII BIOVITRUM AB (SE) 2004-12-29 WO claimed
EP-1461333-A1 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE 1 BIOVITRUM AB (SE) 2004-09-29 EP claimed
US-20030130279-A1 Inhibitors of 11-beta-hydroxy steroid dehydrogenase type 1 BIOVITRUM AB (SE) 2003-07-10 US claimed
WO-2003044009-A1 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE 1 BIOVITRUM AB (SE) 2003-05-30 WO claimed
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 GHSR 977/4885ALDH1A1 47/4885PKM 1850/4885

“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.