SCHEMBL2325997

SCHEMBL2325997

Cc1cc(Cl)ccc1-c1cc2c(nn1)[C@H]1CC[C@@H]2C1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 2/20 0.38
ACHE P22303 2/20 0.36
SLC6A3 Q01959 1/20 0.34
SLC6A4 P31645 2/20 0.34
AVPR1A P37288 3/20 0.33
PROKR1 Q8TCW9 2/20 0.33
TAAR1 Q96RJ0 1/20 0.32
CHRNB2 P17787 1/20 0.32
CHRNA4 P43681 1/20 0.32
HSD11B1 P28845 1/20 0.32
PDE4A P27815 1/20 0.32
PDE4B Q07343 1/20 0.32
PDE4C Q08493 1/20 0.32
PDE4D Q08499 1/20 0.32
ABL1 P00519 1/20 0.32

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
SCHEMBL2321830 0.86 LMNA (0.37) CHRNB2CHRNA4
SCHEMBL2322038 0.86 KMT2A (0.42) ACHESLC6A3SLC6A4CHRNB2CHRNA4
SCHEMBL2321845 0.84 CYP11B1 (0.39) SLC6A3SLC6A4AVPR1ACHRNB2CHRNA4
SCHEMBL2322727 0.83 CNR2 (0.39) ACHESLC6A3SLC6A4CHRNB2CHRNA4
SCHEMBL2322849 0.82 RAB9A (0.43)
SCHEMBL2325071 0.78 ACHE (0.34) NOTUMACHESLC6A4PROKR1CHRNB2
SCHEMBL2326805 0.77 CNR2 (0.39)
SCHEMBL2322920 0.76 NISCH (0.37) SLC6A3SLC6A4CHRNB2CHRNA4HSD11B1
SCHEMBL2325609 0.74 CNR2 (0.44) NOTUMACHESLC6A3
SCHEMBL2323614 0.70 NPC1 (0.36) ACHE

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 NOTUM 2418/4885ACHE 3227/4885SLC6A3 2919/4885

“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.