SCHEMBL3467488

SCHEMBL3467488

COc1ccc(Cc2nnc(NS(=O)(=O)c3ccc(Br)cc3)s2)cc1

nearest known ligand 0.79

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 11/20 0.79
GGT1 P19440 1/20 0.79
POLB P06746 1/20 0.75
MEN1 O00255 3/20 0.73
KMT2A Q03164 3/20 0.73
MAPT P10636 4/20 0.69
SMN1; SMN2 Q16637 3/20 0.69
PKM P14618 2/20 0.66
HPGD P15428 2/20 0.59
HSD17B10 Q99714 2/20 0.56
TSHR P16473 1/20 0.56
LMNA P02545 1/20 0.56
TDP1 Q9NUW8 1/20 0.55
CA1 P00915 1/20 0.54

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
SCHEMBL3011618 0.88 ALDH1A1 (1.00) ALDH1A1GGT1POLBMEN1KMT2A
SCHEMBL5404458 0.86 POLB (1.00) ALDH1A1GGT1POLBMEN1KMT2A
SCHEMBL5393345 0.85 ALDH1A1 (0.66) ALDH1A1GGT1POLBMEN1KMT2A
SCHEMBL5394947 0.81 SMN1; SMN2 (1.00) ALDH1A1MEN1KMT2ASMN1; SMN2PKM
Glysobuzole SCHEMBL1815623 0.79 ALDH1A1 (1.00) ALDH1A1GGT1POLBMEN1KMT2A
SCHEMBL3467612 0.78 MEN1 (0.67) ALDH1A1GGT1POLBMEN1KMT2A
SCHEMBL5390639 0.78 ALDH1A1 (0.73) ALDH1A1GGT1POLBMEN1KMT2A
SCHEMBL5396055 0.76 ALDH1A1 (0.77) ALDH1A1MEN1KMT2AMAPTSMN1; SMN2
SCHEMBL18077365 0.75 ALDH1A1 (1.00) ALDH1A1GGT1POLBMEN1KMT2A
SCHEMBL3467266 0.75 ALDH1A1 (0.62) ALDH1A1GGT1POLBMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010073011-A2 COMPOUNDS USEFUL AS MEDICAMENTS BETAGENON AB (SE) 2010-07-01 WO claimed
US-20070066614-A1 Ihibitors of 11-beta-hydroxy steroid dehydrogenase type 1 BIOVITRUM AB 2007-03-22 US claimed
US-7173030-B2 Inhibitors of 11-β-hydroxy steroid dehydrogenase type 1 BIOVITRUM AB (SE) 2007-02-06 US claimed
EP-1631558-A1 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE I BIOVITRUM AB (SE) 2006-03-08 EP claimed
US-20050009821-A1 Inhibitors of 11-beta-hydroxy steroid dehydrogenase type 1 BIOVITRUM AB 2005-01-13 US claimed
WO-2004103980-A1 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE I BIOVITRUM AB (SE) 2004-12-02 WO claimed
WO-2010073011-A2 COMPOUNDS USEFUL AS MEDICAMENTS BETAGENON AB (SE) 2010-07-01 WO disclosed
US-20070066614-A1 Ihibitors of 11-beta-hydroxy steroid dehydrogenase type 1 BIOVITRUM AB 2007-03-22 US disclosed
US-7173030-B2 Inhibitors of 11-β-hydroxy steroid dehydrogenase type 1 BIOVITRUM AB (SE) 2007-02-06 US disclosed
EP-1631558-A1 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE I BIOVITRUM AB (SE) 2006-03-08 EP disclosed
US-20050009821-A1 Inhibitors of 11-beta-hydroxy steroid dehydrogenase type 1 BIOVITRUM AB 2005-01-13 US disclosed
WO-2004103980-A1 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE I BIOVITRUM AB (SE) 2004-12-02 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 (2 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-20050009821-A1 Inhibitors of 11-beta-hydroxy steroid dehydrogenase type 1 HSD11B1, HSD17B1, HSD11B2 ALDH1A1 53/4885GGT1 98/4885POLB 615/4885
US-20070066614-A1 Ihibitors of 11-beta-hydroxy steroid dehydrogenase type 1 HSD11B1, HSD17B1, HSD17B11 ALDH1A1 36/4885GGT1 168/4885POLB 932/4885

“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.