SCHEMBL3528882

SCHEMBL3528882

CCn1c(C2CC2)cc(=O)n1-c1cccc(Cl)c1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
HSP90AA1 P07900 1/20 0.40
DRD2 P14416 2/20 0.39
DRD3 P35462 2/20 0.39
KCNH2 Q12809 2/20 0.39
HTR1A P08908 2/20 0.39
P2RX7 Q99572 1/20 0.37
GRM2 Q14416 1/20 0.37
ALOX5 P09917 1/20 0.36
MGLL Q99685 1/20 0.36

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
SCHEMBL3533392 0.85 GRM2 (0.38) MEN1KMT2AGRM2ALOX5MGLL
SCHEMBL3529011 0.82 NAPRT (0.41) MEN1KMT2ADRD2DRD3KCNH2
SCHEMBL3533087 0.78 MCHR1 (0.33) P2RX7GRM2
SCHEMBL3528842 0.76 HSD11B1 (0.40) MEN1KMT2AHSP90AA1DRD2DRD3
SCHEMBL3531163 0.76 MEN1 (0.38) MEN1KMT2AHSP90AA1DRD2DRD3
SCHEMBL3535897 0.70 HSD11B1 (0.39) MEN1KMT2AP2RX7
SCHEMBL9435123 0.67 MAPT (0.45) MEN1KMT2AHTR1A
SCHEMBL3533567 0.67 FAAH (0.41) MEN1KMT2ADRD2DRD3GRM2
SCHEMBL3531384 0.66 NAPRT (0.57) MEN1KMT2A
SCHEMBL3529938 0.66 HSD11B1 (0.40) MEN1KMT2ADRD2DRD3KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7652057-B2 Pyrazolones as 11b-HSD1 inhibitors for diabetes HOFFMAN-LA ROCHE INC. (US) 2010-01-26 US disclosed
EP-1924562-A2 PYRAZOLONE DERIVATIVES F.HOFFMANN-LA ROCHE AG (CH) 2008-05-28 EP disclosed
WO-2007025880-A2 PYRAZOLONE DERIVATIVES AS 11-BETA HSD1 INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2007-03-08 WO disclosed
US-20070049574-A1 New pyrazolones as 11b-HSD1 inhibitors for diabetes F. HOFFMANN-LA ROCHE AG (CH) 2007-03-01 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-20070049574-A1 New pyrazolones as 11b-HSD1 inhibitors for diabetes HSD11B1, HSD17B1, HSD17B7 MEN1 1683/4885KMT2A 4086/4885HSP90AA1 1743/4885

“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.