SCHEMBL2322937

SCHEMBL2322937

Fc1ccc(-c2cc3c(nn2)C2CCC3C2)c(F)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 1/20 0.37
CYP11B2 P19099 1/20 0.37
KMO O15229 2/20 0.34
GABRG2 P18507 2/20 0.34
GABRB3 P28472 2/20 0.34
GABRA5 P31644 2/20 0.34
GABRA3 P34903 2/20 0.34
MAPK14 Q16539 1/20 0.34
MAOA P21397 6/20 0.33
MAOB P27338 6/20 0.33
CNR1 P21554 1/20 0.33
CNR2 P34972 1/20 0.33
CHRNB2 P17787 1/20 0.33
CHRNB4 P30926 1/20 0.33
CHRNA3 P32297 1/20 0.33
CHRNA4 P43681 1/20 0.33
SLC6A4 P31645 6/20 0.33
HTR1A P08908 1/20 0.33
DRD1 P21728 1/20 0.33
SLC6A2 P23975 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
SCHEMBL2321845 0.86 CYP11B1 (0.39) CYP11B1CYP11B2CHRNB2CHRNB4CHRNA3
SCHEMBL2322920 0.86 NISCH (0.37) MAPK14CNR2CHRNB2CHRNB4CHRNA3
SCHEMBL2323614 0.84 NPC1 (0.36) GABRG2GABRB3GABRA5GABRA3
SCHEMBL2325391 0.84 AR (0.40) CHRNB2CHRNB4CHRNA3CHRNA4SLC6A4
SCHEMBL2322258 0.81 NOTUM (0.34) CHRNB2CHRNB4CHRNA3CHRNA4SLC6A4
SCHEMBL2325039 0.80 CDK9 (0.40) HTR2A
SCHEMBL1549035 0.75 AR (0.41)
SCHEMBL2324690 0.75 TRPA1 (0.35) CNR2CHRNB2CHRNA4SLC6A4
SCHEMBL2321830 0.74 LMNA (0.37) CHRNB2CHRNA4
SCHEMBL2322849 0.72 RAB9A (0.43) MAOBCNR2

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 CYP11B1 8/4885CYP11B2 15/4885KMO 1468/4885

“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.