SCHEMBL6609567

SCHEMBL6609567

O=S(=O)(Nc1cscc1-c1ccccc1Cl)c1ccc(Cl)c(Cl)c1Cl

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTGES2 Q9H7Z7 8/20 0.46
ACLY P53396 1/20 0.42
POLB P06746 1/20 0.41
CASP6 P55212 1/20 0.41
CTDSP1 Q9GZU7 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
SLC40A1 Q9NP59 1/20 0.41
PFKFB3 Q16875 1/20 0.39
PKM P14618 1/20 0.39
CCR4 P51679 2/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
HTT P42858 1/20 0.39
MCL1 Q07820 1/20 0.38
PGR P06401 1/20 0.38
GRM4 Q14833 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
SCHEMBL6616015 0.81 SLC40A1 (0.53) PTGES2POLBCASP6CTDSP1TDP1
SCHEMBL6613845 0.80 USP2 (0.44) PTGES2ACLYPOLBSLC40A1PFKFB3
SCHEMBL6614439 0.78 PTGES2 (0.45) PTGES2ACLYPOLBCASP6CTDSP1
SCHEMBL6694171 0.77 SLC40A1 (0.48) ACLYPOLBCASP6CTDSP1TDP1
SCHEMBL6612943 0.76 MEN1 (0.53) PTGES2ACLYHTT
SCHEMBL2762814 0.76 KDM1A (0.63) POLBKDM4EALDH1A1HPGDHTT
SCHEMBL6615994 0.76 MCL1 (0.44) ACLYPOLBSLC40A1ALDH1A1HTT
SCHEMBL6614920 0.75 PTGES2 (0.56) PTGES2ACLYPOLBCASP6CTDSP1
SCHEMBL5831646 0.75 GUSB (0.49) PTGES2PFKFB3PKMKDM4EALDH1A1
SCHEMBL5830661 0.73 KDM1A (0.40) PTGES2ACLYPOLBCASP6CTDSP1

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 9 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-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 PTGES2 1300/4885ACLY 707/4885POLB 557/4885

“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.