SCHEMBL2325071

SCHEMBL2325071

FC(F)(F)c1ccc(Cl)cc1-c1cc2c(nn1)C1CCC2C1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.34
NOTUM Q6P988 2/20 0.33
ALOX5AP P20292 1/20 0.33
FEN1 P39748 1/20 0.33
RBP4 P02753 1/20 0.33
HSD11B1 P28845 2/20 0.33
CHRNB2 P17787 1/20 0.33
CHRNA4 P43681 1/20 0.33
SLC6A4 P31645 2/20 0.32
NOS3 P29474 1/20 0.32
NOS1 P29475 1/20 0.32
NOS2 P35228 1/20 0.32
PROKR1 Q8TCW9 1/20 0.32
PLAT P00750 1/20 0.31
TRPA1 O75762 1/20 0.31

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
SCHEMBL2322258 0.86 NOTUM (0.34) NOTUMRBP4CHRNB2CHRNA4SLC6A4
SCHEMBL2325632 0.83 TRPA1 (0.43) NOTUMRBP4HSD11B1CHRNB2CHRNA4
SCHEMBL2322727 0.83 CNR2 (0.39) ACHECHRNB2CHRNA4SLC6A4
SCHEMBL2322038 0.80 KMT2A (0.42) ACHEHSD11B1CHRNB2CHRNA4SLC6A4
SCHEMBL2325391 0.79 AR (0.40) NOTUMALOX5APFEN1CHRNB2CHRNA4
SCHEMBL2325997 0.78 NOTUM (0.38) ACHENOTUMHSD11B1CHRNB2CHRNA4
SCHEMBL1384167 0.75 TRPA1 (0.47) NOTUMRBP4HSD11B1TRPA1
SCHEMBL2322920 0.73 NISCH (0.37) HSD11B1CHRNB2CHRNA4SLC6A4
SCHEMBL2324690 0.72 TRPA1 (0.35) RBP4CHRNB2CHRNA4SLC6A4TRPA1
SCHEMBL2325609 0.71 CNR2 (0.44) ACHENOTUM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1904455-B1 PYRIDAZINE DERIVATIVES HOFFMANN LA ROCHE (CH) 2011-08-17 EP claimed
US-7678795-B2 Pyridazines as 11b-HSD1 inhibitors HOFFMAN-LA ROCHE INC. (US) 2010-03-16 US claimed
US-20070010519-A1 New pyridazines as 11B-HSD1 inhibitors HOFFMANN-LA ROCHE INC. 2007-01-11 US claimed
EP-1904455-B1 PYRIDAZINE DERIVATIVES HOFFMANN LA ROCHE (CH) 2011-08-17 EP disclosed
US-7678795-B2 Pyridazines as 11b-HSD1 inhibitors HOFFMAN-LA ROCHE INC. (US) 2010-03-16 US disclosed
US-20070010519-A1 New pyridazines as 11B-HSD1 inhibitors HOFFMANN-LA ROCHE INC. 2007-01-11 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-20070010519-A1 New pyridazines as 11B-HSD1 inhibitors HSD11B1, HSD17B1, HSD17B11 ACHE 3227/4885NOTUM 2418/4885ALOX5AP 2350/4885

“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.