SCHEMBL3909496

SCHEMBL3909496

CC(C)Cn1[nH]c(=O)c2cc(NS(=O)(=O)c3cccc(C(F)(F)F)c3)ccc21

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B2 P37059 1/20 0.49
HTR6 P50406 3/20 0.46
HIF1A Q16665 1/20 0.45
NR3C1 P04150 1/20 0.45
PGR P06401 1/20 0.45
AR P10275 1/20 0.45
ESR2 Q92731 1/20 0.45
TOP2A P11388 1/20 0.44
PTPN2 P17706 2/20 0.43
PTPN1 P18031 2/20 0.43
PTPN5 P54829 2/20 0.43
TSHR P16473 1/20 0.43
HSPD1 P10809 1/20 0.43
HSPE1 P61604 1/20 0.43
FFAR1 O14842 1/20 0.43
CDK1 P06493 1/20 0.43
CCNB1 P14635 1/20 0.43
CCNA2 P20248 1/20 0.43
CDK2 P24941 1/20 0.43
CDK7 P50613 1/20 0.43

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
SCHEMBL3908386 0.87 HSD17B2 (0.50) HSD17B2HTR6HIF1ANR3C1PGR
SCHEMBL1807440 0.85 NR3C1 (0.51) HSD17B2HTR6HIF1ANR3C1PGR
SCHEMBL3906955 0.84 PTPN2 (0.43) PTPN2PTPN1PTPN5HSPD1HSPE1
SCHEMBL3917148 0.83 NR3C1 (0.48) HSD17B2HTR6HIF1ANR3C1PGR
SCHEMBL3916133 0.83 BRD4 (0.42) PGRTSHRTP53HDAC1HDAC8
SCHEMBL3906469 0.83 BRPF1 (0.54) HSD17B2HTR6PGRPTPN2PTPN1
SCHEMBL1812408 0.80 MEN1 (0.46) HTR6TSHRTP53MAPTKMT2A
SCHEMBL3911015 0.78 PPARG (0.44) HSD17B2NR3C1PGRARESR2
SCHEMBL3909458 0.78 PKM (0.51) HTR6GAATP53MAPTKMT2A
SCHEMBL3908711 0.77 BRPF1 (0.55) HTR6PTPN2PTPN1PTPN5HSPD1

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 HSD17B2 6/4885HTR6 2847/4885HIF1A 2500/4885

“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.