SCHEMBL3664581

SCHEMBL3664581

O=C(c1csc(C2CCOCC2)c1)N1CCCCC1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HPGD P15428 8/20 0.55
MAPK1 P28482 1/20 0.55
L3MBTL3 Q96JM7 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
ALDH1A1 P00352 2/20 0.44
CNR2 P34972 1/20 0.43
HRH3 Q9Y5N1 2/20 0.43
TSHR P16473 1/20 0.43
RECQL P46063 1/20 0.43
KDM4E B2RXH2 1/20 0.41
POLB P06746 1/20 0.41
ALOX15 P16050 1/20 0.41
HSD17B10 Q99714 1/20 0.41
MAOA P21397 2/20 0.40
KDM1A O60341 1/20 0.40
KMT2A Q03164 1/20 0.40
CNR1 P21554 1/20 0.40
KCNH2 Q12809 1/20 0.40

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
SCHEMBL3660247 1.00 HPGD (0.55) HPGDMAPK1L3MBTL3L3MBTL1ALDH1A1
SCHEMBL3659427 0.88 HPGD (0.60) HPGDMAPK1L3MBTL3L3MBTL1ALDH1A1
SCHEMBL13124500 0.85 HPGD (0.43) HPGDMAPK1L3MBTL3L3MBTL1ALDH1A1
SCHEMBL13124644 0.85 GRM5 (0.46) HPGDMAPK1ALDH1A1CNR2HRH3
SCHEMBL13124497 0.85 HPGD (0.46) HPGDMAPK1L3MBTL3L3MBTL1ALDH1A1
SCHEMBL13124794 0.85 MAOB (0.43) HPGDMAPK1L3MBTL3L3MBTL1ALDH1A1
SCHEMBL13124960 0.84 HPGD (0.56) HPGDMAPK1L3MBTL3L3MBTL1ALDH1A1
SCHEMBL13124473 0.84 HPGD (0.49) HPGDMAPK1L3MBTL3L3MBTL1ALDH1A1
SCHEMBL13124439 0.84 HPGD (0.46) HPGDMAPK1L3MBTL1ALDH1A1CNR2
SCHEMBL3712460 0.83 HPGD (0.55) HPGDMAPK1L3MBTL3L3MBTL1ALDH1A1

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
US-8362008-B2 Amido-thiophene compounds and their use as 11-beta-HSD1 inhibitors THE UNIVERSITY OF EDINBURGH (GB) 2013-01-29 US disclosed
US-8362008-B2 Amido-thiophene compounds and their use as 11-beta-HSD1 inhibitors THE UNIVERSITY OF EDINBURGH (GB) 2013-01-29 US disclosed
US-8362008-B2 Amido-thiophene compounds and their use as 11-beta-HSD1 inhibitors THE UNIVERSITY OF EDINBURGH (GB) 2013-01-29 US disclosed
US-20100267696-A1 Amido-Thiophene Compounds and Their Use as 11-Beta-HSD1 Inhibitors THE UNIVERSITY OF EDINBURGH 2010-10-21 US disclosed
US-20100267696-A1 Amido-Thiophene Compounds and Their Use as 11-Beta-HSD1 Inhibitors THE UNIVERSITY OF EDINBURGH 2010-10-21 US disclosed
US-20100267696-A1 Amido-Thiophene Compounds and Their Use as 11-Beta-HSD1 Inhibitors THE UNIVERSITY OF EDINBURGH 2010-10-21 US disclosed
EP-2229374-A1 AMIDO-THIOPHENE COMPOUNDS AND THEIR USE AS 11-BETA-HSD1 INHIBITORS THE UNIVERSITY OF EDINBURGH (GB) 2010-09-22 EP disclosed
WO-2009074789-A1 AMIDO-THIOPHENE COMPOUNDS AND THEIR USE AS 11-BETA-HSD1 INHIBITORS THE UNIVERSITY OF EDINBURGH (GB) 2009-06-18 WO disclosed
WO-2009074789-A1 AMIDO-THIOPHENE COMPOUNDS AND THEIR USE AS 11-BETA-HSD1 INHIBITORS THE UNIVERSITY OF EDINBURGH (GB) 2009-06-18 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-20100267696-A1 Amido-Thiophene Compounds and Their Use as 11-Beta-HSD1 Inhibitors HSD11B1, HSD11B2, HSD17B1 HPGD 190/4885MAPK1 477/4885L3MBTL3 4454/4885

“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.