SCHEMBL6612424

SCHEMBL6612424

O=S(=O)(Nc1ccsc1-c1ccccc1)c1c(Cl)cc(Cl)cc1Cl

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ACLY P53396 15/20 0.46
SLC40A1 Q9NP59 1/20 0.45
CA2 P00918 3/20 0.44
CA9 Q16790 3/20 0.44
ACACB O00763 1/20 0.41
ACACA Q13085 1/20 0.41

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
SCHEMBL6610751 0.91 PFKFB3 (0.46) ACLYCA2CA9ACACBACACA
SCHEMBL6611536 0.85 SLC40A1 (0.44) ACLYSLC40A1CA2CA9
SCHEMBL6616114 0.85 SLC40A1 (0.48) ACLYSLC40A1
SCHEMBL6692691 0.85 SLC40A1 (0.45) ACLYSLC40A1
SCHEMBL6623115 0.81 ATM (0.51) ACLY
SCHEMBL6611783 0.79 SLC40A1 (0.41) ACLYSLC40A1CA2CA9
SCHEMBL6614194 0.78 CYP2E1 (0.47) ACLYSLC40A1
SCHEMBL6691572 0.78 SMN1; SMN2 (0.41) ACLYSLC40A1CA2CA9
SCHEMBL6698387 0.76 PFKFB3 (0.41) ACLYSLC40A1
SCHEMBL6692655 0.76 SLC40A1 (0.48) ACLYSLC40A1

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 7 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
US-20030130279-A1 Inhibitors of 11-beta-hydroxy steroid dehydrogenase type 1 BIOVITRUM AB (SE) 2003-07-10 US claimed
WO-2019075394-A1 COMPOUNDS FOR TREATMENT OF EMOTIONAL/PSYCHOLOGICAL SYMPTOMS IN FRAGILE X SYNDROME VANDERKLISH PETER (US) 2019-04-18 WO disclosed
WO-2004112779-A1 NEW USE VII BIOVITRUM AB (SE) 2004-12-29 WO disclosed
EP-1461333-A1 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE 1 BIOVITRUM AB (SE) 2004-09-29 EP disclosed
US-20030130279-A1 Inhibitors of 11-beta-hydroxy steroid dehydrogenase type 1 BIOVITRUM AB (SE) 2003-07-10 US disclosed
WO-2003044009-A1 INHIBITORS OF 11-BETA-HYDROXY STEROID DEHYDROGENASE TYPE 1 BIOVITRUM AB (SE) 2003-05-30 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 (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 ACLY 707/4885SLC40A1 2287/4885CA2 2538/4885

“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.