SCHEMBL3906452

SCHEMBL3906452

O=c1[nH]n(Cc2ccccc2)c2cc(F)c(NS(=O)(=O)c3cccc(Cl)c3F)cc12

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ACLY P53396 8/20 0.54
BRD4 O60885 2/20 0.47
PTGES2 Q9H7Z7 2/20 0.47
CCR2 P41597 4/20 0.43
KIT P10721 1/20 0.42
SLC40A1 Q9NP59 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
SCHEMBL1811117 0.93 ACLY (0.47) ACLYBRD4PTGES2CCR2KIT
SCHEMBL3906639 0.92 ACLY (0.54) ACLYBRD4PTGES2
SCHEMBL3906066 0.86 ACLY (0.43) ACLYBRD4CCR2SLC40A1
SCHEMBL3902067 0.86 ACLY (0.53) ACLYBRD4CCR2
SCHEMBL1810122 0.84 BRD4 (0.44) ACLYBRD4CCR2
SCHEMBL3917122 0.83 NR1I2 (0.45) BRD4SLC40A1
SCHEMBL1811881 0.83 PTGES2 (0.46) ACLYBRD4PTGES2
SCHEMBL1818133 0.81 PKM (0.43) BRD4SLC40A1
SCHEMBL3906458 0.81 ACLY (0.47) ACLYCCR2
SCHEMBL1811874 0.81 DAO (0.38) ACLY

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101027286-B Indazolone derivatives as 11b-HSD1 inhibitors HOFFMANN LA ROCHE 2011-05-25 CN claimed
US-7528158-B2 Indazolone derivatives useful as 11b-HSD1 inhibitors HOFFMANN-LA ROCHE INC. (US) 2009-05-05 US claimed
EP-1797042-B1 INDOZOLONE DERIVATIVES AS 11B-HSD1 INHIBITORS HOFFMANN LA ROCHE (CH) 2009-01-07 EP claimed
CN-101027286-A Indazolone derivatives as 11 b-HSD 1 inhibitors HOFFMANN LA ROCHE (CH) 2007-08-29 CN claimed
US-20060069269-A1 Novel indazolone derivatives useful as 11b-HSD1 inhibitors F. HOFFMANN-LA ROCHE AG, A SWISS COMPANY (CH) 2006-03-30 US claimed
CN-101027286-B Indazolone derivatives as 11b-HSD1 inhibitors HOFFMANN LA ROCHE 2011-05-25 CN disclosed
US-7528158-B2 Indazolone derivatives useful as 11b-HSD1 inhibitors HOFFMANN-LA ROCHE INC. (US) 2009-05-05 US disclosed
EP-1797042-B1 INDOZOLONE DERIVATIVES AS 11B-HSD1 INHIBITORS HOFFMANN LA ROCHE (CH) 2009-01-07 EP disclosed
CN-101027286-A Indazolone derivatives as 11 b-HSD 1 inhibitors HOFFMANN LA ROCHE (CH) 2007-08-29 CN disclosed
EP-1797042-A1 INDOZOLONE DERIVATIVES AS 11B-HSD1 INHIBITORS F.HOFFMANN-LA ROCHE AG (CH) 2007-06-20 EP disclosed
WO-2006034804-A1 INDOZOLONE DERIVATIVES AS 11B-HSD1 INHIBITORS F.HOFFMANN-LA ROCHE AG (CH) 2006-04-06 WO disclosed
US-20060069269-A1 Novel indazolone derivatives useful as 11b-HSD1 inhibitors F. HOFFMANN-LA ROCHE AG, A SWISS COMPANY (CH) 2006-03-30 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-20060069269-A1 Novel indazolone derivatives useful as 11b-HSD1 inhibitors HSD17B1, HSD11B1, HSD17B7 ACLY 2238/4885BRD4 2606/4885PTGES2 1207/4885

“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.