SCHEMBL1406887

SCHEMBL1406887

COCCCn1ncc(C(=O)O)c1Cl

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 5/20 0.42
HTT P42858 1/20 0.40
MAPK1 P28482 2/20 0.38
ALKBH1 Q13686 1/20 0.37
KMO O15229 1/20 0.35
PDE4B Q07343 1/20 0.34
PDE4D Q08499 1/20 0.34
MAOA P21397 1/20 0.34
MAOB P27338 1/20 0.34
HCAR3 P49019 1/20 0.34
CNR1 P21554 1/20 0.34
CNR2 P34972 1/20 0.34
KDM4C Q9H3R0 1/20 0.34
IRAK4 Q9NWZ3 1/20 0.34

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
SCHEMBL1406641 0.91 HCAR3 (0.41) NR3C1MAPK1ALKBH1MAOAMAOB
SCHEMBL1407003 0.86 ALKBH1 (0.36) NR3C1ALKBH1MAOAMAOBHCAR3
SCHEMBL1406926 0.83 LMNA (0.46) HTT
SCHEMBL4716749 0.83 AGTR1 (0.41) ALKBH1KMOPDE4BPDE4DHCAR3
SCHEMBL27737639 0.82 ALDH1A1 (0.42) HTTMAPK1
SCHEMBL3290176 0.79 ALKBH1 (0.35) NR3C1MAPK1ALKBH1KMOMAOA
SCHEMBL15705467 0.76 APOBEC3G (0.37) NR3C1MAPK1MAOAMAOB
SCHEMBL4968650 0.76 POLB (0.42) HTTMAPK1ALKBH1
SCHEMBL17076654 0.75 ALDH1A1 (0.34) NR3C1MAPK1PDE4BPDE4DMAOA
SCHEMBL3292372 0.75 HTT (0.37) NR3C1HTTMAPK1CNR1CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1999114-B1 PYRAZOLES AS 11-BETA-HSD-1 HOFFMANN LA ROCHE (CH) 2015-07-22 EP disclosed
CN-101405270-B Pyrazoles as 11-beta-HSD-1 HOFFMANN LA ROCHE 2013-01-16 CN disclosed
EP-2295411-A1 Pyrazoles as 11-beta-hsd-1 F. Hoffmann-La Roche AG (CH) 2011-03-16 EP disclosed
US-7728029-B2 Adamantyl-pyrazole carboxamides as inhibitors of 11β-hdroxysteroid dehydrogenase HOFFMANN-LA ROCHE INC. (US) 2010-06-01 US disclosed
CN-101405270-A Pyrazoles as 11-beta-HSD-1 HOFFMANN LA ROCHE (CH) 2009-04-08 CN disclosed
US-20070225280-A1 Adamantyl-pyrazole carboxamides as inhibitors of 11B-hydroxysteroid dehydrogenase ANDERSON KEVIN WILLIAM 2007-09-27 US 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-20070225280-A1 Adamantyl-pyrazole carboxamides as inhibitors of 11B-hydroxysteroid dehydrogenase HSD3B2, HSD3B1, HSD17B2 NR3C1 553/4885HTT 4719/4885MAPK1 2335/4885

“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.