SCHEMBL3928508

SCHEMBL3928508

CCOP(=O)(O)CC(=O)C(C)(C)C1CC1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 1/20 0.39
MMP1 P03956 1/20 0.32
MMP2 P08253 1/20 0.32
FNTA P49354 1/20 0.32
FNTB P49356 1/20 0.32
PGGT1B P53609 1/20 0.32
TSHR P16473 1/20 0.30

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
SCHEMBL1549416 0.78 PPARD (0.47) PPARDFNTAFNTBPGGT1BTSHR
SCHEMBL1131627 0.75 PPARD (0.44) PPARDMMP1MMP2FNTAFNTB
SCHEMBL2326336 0.72 PPARD (0.41) PPARDMMP1MMP2FNTAFNTB
SCHEMBL27769745 0.72 LIPA (0.32)
SCHEMBL10681801 0.70 METAP1 (0.36) MMP1MMP2TSHR
SCHEMBL4936680 0.70 PPARD (0.39) PPARDMMP1MMP2FNTAFNTB
SCHEMBL4940540 0.70 PPARD (0.39) PPARD
SCHEMBL1549162 0.69 PPARD (0.50) PPARDFNTAFNTBPGGT1BTSHR
SCHEMBL3939836 0.69 PPARD (0.41) PPARDMMP1MMP2FNTAFNTB
SCHEMBL4943149 0.68 PPARD (0.37) PPARDMMP1MMP2FNTAFNTB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2044034-B1 ALKYL-PYRIDAZINE DERIVATIVES AS INHIBITORS OF 11 BETA HYDROXYSTEROID DEHYDROGENASE TYPE 1(11B-HSD 1) HOFFMANN LA ROCHE (CH) 2012-08-22 EP disclosed
US-7547697-B2 Alkyl-pyridazine derivatives as 11b-HSD1 inhibitors HOFFMANN-LA ROCHE INC. (US) 2009-06-16 US disclosed
EP-2044034-A1 ALKYL-PYRIDAZINE DERIVATIVES AS INHIBITORS OF 11 BETA HYDROXYSTEROID DEHYDROGENASE TYPE 1(11B-HSD 1) F. Hoffmann-Roche AG (CH) 2009-04-08 EP disclosed
WO-2008003611-A1 ALKYL-PYRIDAZINE DERIVATIVES AS INHIBITORS OF 11 BETA HYDROXYSTEROID DEHYDROGENASE TYPE 1(11B-HSD 1) F. HOFFMANN-LA ROCHE AG (CH) 2008-01-10 WO disclosed
US-20080009499-A1 Alkyl-pyridazine derivatives as 11b-HSD1 inhibitors HOFFMANN-LA ROCHE INC. 2008-01-10 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-20080009499-A1 Alkyl-pyridazine derivatives as 11b-HSD1 inhibitors HSD11B1, HSD17B1, HSD17B11 PPARD 334/4885MMP1 492/4885MMP2 874/4885

“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.