SCHEMBL3613133

SCHEMBL3613133

O=C(Cc1csc(NS(=O)(=O)c2ccc(Oc3ccccc3)cc2)n1)N1CCOCC1

nearest known ligand 0.60

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 3/20 0.60
▸ ALDH1A1 P00352 4/20 0.52
▸ CYP2C9 P11712 1/20 0.52
▸ CYP2C19 P33261 1/20 0.52
▸ PKM P14618 1/20 0.49
▸ HSD17B1 P14061 1/20 0.48
▸ HSD17B2 P37059 1/20 0.48
▸ KMT2A Q03164 5/20 0.48
▸ MEN1 O00255 3/20 0.48
▸ SMN1; SMN2 Q16637 4/20 0.47
▸ HTT P42858 3/20 0.47
▸ KDM4E B2RXH2 1/20 0.47
▸ LMNA P02545 4/20 0.46
▸ ADRB2 P07550 1/20 0.46
▸ GAA P10253 1/20 0.45
▸ STAT3 P40763 1/20 0.44
▸ POLB P06746 1/20 0.44

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
SCHEMBL3615296 0.91 HSD11B1 (0.67) HSD11B1ALDH1A1CYP2C9CYP2C19PKM
SCHEMBL3614418 0.90 HSD11B1 (0.63) HSD11B1ALDH1A1CYP2C9CYP2C19PKM
SCHEMBL3611790 0.88 HSD11B1 (0.61) HSD11B1ALDH1A1CYP2C9CYP2C19PKM
SCHEMBL3606758 0.85 HSD11B1 (0.65) HSD11B1ALDH1A1CYP2C9CYP2C19PKM
SCHEMBL3619100 0.85 HSD11B1 (0.65) HSD11B1ALDH1A1CYP2C9CYP2C19PKM
SCHEMBL3618766 0.85 HSD11B1 (0.57) HSD11B1ALDH1A1CYP2C9CYP2C19HSD17B1
SCHEMBL3615845 0.84 HSD11B1 (0.61) HSD11B1ALDH1A1CYP2C9CYP2C19PKM
SCHEMBL5831017 0.84 SMN1; SMN2 (0.48) HSD11B1ALDH1A1CYP2C9KMT2ASMN1; SMN2
SCHEMBL3611317 0.84 HSD11B1 (0.56) HSD11B1ALDH1A1CYP2C9CYP2C19PKM
SCHEMBL3252937 0.84 HSD11B1 (0.63) HSD11B1ALDH1A1CYP2C9CYP2C19PKM

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
US-20100113435-A1 INHIBITORS OF 11-BETA-HYDROXY STERIOD DEHYDROGENASE TYPE 1 BIOVITRUM AB 2010-05-06 — — US claimed
US-7618961-B2 Inhibitors of 11-beta-hydroxy steroid dehydrogenase type 1 BIOVITRUM AB (SE) 2009-11-17 — — US claimed
US-20040224996-A1 Inhibitors of 11-beta-hydroxy steroid dehydrogenase type 1 BIOVITRUM AB (SE) 2004-11-11 — — US claimed
EP-1283831-A1 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE 1 BIOVITRUM AB (SE) 2003-02-19 — — EP claimed
WO-2001090090-A1 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE 1 BIOVITRUM AB (SE) 2001-11-29 — — WO claimed
US-20100113435-A1 INHIBITORS OF 11-BETA-HYDROXY STERIOD DEHYDROGENASE TYPE 1 BIOVITRUM AB 2010-05-06 — — US disclosed
US-7618961-B2 Inhibitors of 11-beta-hydroxy steroid dehydrogenase type 1 BIOVITRUM AB (SE) 2009-11-17 — — US disclosed
EP-1638553-A1 NEW USE I BIOVITRUM AB (SE) 2006-03-29 — — EP disclosed
WO-2004112784-A1 NEW USE I BIOVITRUM AB (SE) 2004-12-29 — — WO disclosed
US-20040224996-A1 Inhibitors of 11-beta-hydroxy steroid dehydrogenase type 1 BIOVITRUM AB (SE) 2004-11-11 — — US disclosed
EP-1283831-A1 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE 1 BIOVITRUM AB (SE) 2003-02-19 — — EP disclosed
WO-2001090090-A1 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE 1 BIOVITRUM AB (SE) 2001-11-29 — — 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-20040224996-A1 Inhibitors of 11-beta-hydroxy steroid dehydrogenase type 1 HSD11B1, HSD17B1, HSD11B2 HSD11B1 1/4885ALDH1A1 55/4885CYP2C9 179/4885
US-20100113435-A1 INHIBITORS OF 11-BETA-HYDROXY STERIOD DEHYDROGENASE TYPE 1 HSD11B1, HSD17B1, HSD3B1 HSD11B1 1/4885ALDH1A1 59/4885CYP2C9 194/4885

“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.

Send feedback