SCHEMBL3528349

SCHEMBL3528349

O=C1CC(C2CC2)=NN1c1ccc(F)cc1C(F)(F)F

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HCAR1 Q9BXC0 1/20 0.40
HSD11B1 P28845 10/20 0.37
P2RX7 Q99572 7/20 0.35
EPHX2 P34913 1/20 0.34
TRPC5 Q9UL62 1/20 0.33

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
SCHEMBL3531063 0.84 CNR2 (0.38) P2RX7
SCHEMBL3529246 0.83 ALDH1A1 (0.40) HCAR1HSD11B1
SCHEMBL3527050 0.78 L3MBTL1 (0.39) HCAR1HSD11B1P2RX7
SCHEMBL3531736 0.75 KMT2A (0.44)
SCHEMBL3529900 0.74 HCAR1 (0.40) HCAR1P2RX7
SCHEMBL3535982 0.73 KMT2A (0.47)
SCHEMBL3525750 0.72 XPO1 (0.33)
SCHEMBL3533237 0.72 MEN1 (0.45) HCAR1
SCHEMBL3531484 0.72 HCAR1 (0.47) HCAR1P2RX7TRPC5
SCHEMBL27732316 0.72 HCAR1 (0.36) HCAR1HSD11B1P2RX7

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 HCAR1 946/4885HSD11B1 1/4885P2RX7 2161/4885

“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.