SCHEMBL5573406

SCHEMBL5573406

Cc1ccc(C2CCCn3cncc32)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP17A1 P05093 1/20 0.44
CYP19A1 P11511 2/20 0.43
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
SLC6A3 Q01959 1/20 0.35
CHRNB2 P17787 3/20 0.34
CHRNB1 P11230 2/20 0.34
CHRNB4 P30926 2/20 0.34
CHRNA3 P32297 2/20 0.34
CHRNB3 Q05901 2/20 0.34
SLC18A3 Q16572 1/20 0.33
PROKR1 Q8TCW9 2/20 0.33
IDO1 P14902 1/20 0.33
TDO2 P48775 1/20 0.33
TDP1 Q9NUW8 3/20 0.33
MAPT P10636 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
HTT P42858 1/20 0.33
LMNA P02545 2/20 0.33
L3MBTL1 Q9Y468 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
SCHEMBL5573336 0.85 CYP17A1 (0.43) CYP17A1CYP19A1CHRNB2CHRNB1CHRNB4
SCHEMBL27285097 0.85 CYP17A1 (0.42) CYP17A1CYP19A1SLC18A3ALDH1A1
SCHEMBL27285997 0.85 CYP17A1 (0.42) CYP17A1CYP19A1SLC18A3ALDH1A1
SCHEMBL5573400 0.85 CYP17A1 (0.42) CYP17A1CHRNB2CHRNB1CHRNB4CHRNA3
SCHEMBL27285101 0.85 CYP17A1 (0.42) CYP17A1CYP19A1SLC18A3ALDH1A1
SCHEMBL5573376 0.85 CYP17A1 (0.42) CYP17A1CHRNB2CHRNB1CHRNB4CHRNA3
SCHEMBL5572854 0.85 CYP19A1 (0.43) CYP17A1CYP19A1
SCHEMBL1180209 0.84 CYP17A1 (0.41) CYP17A1CYP19A1CHRNB2CHRNB1CHRNB4
SCHEMBL1180595 0.84 CYP17A1 (0.41) CYP17A1CHRNB2CHRNB1CHRNB4CHRNA3
SCHEMBL5570972 0.84 CYP17A1 (0.45) CYP17A1CHRNB2CHRNB1CHRNB4CHRNA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8680079-B2 Tetrahydro-imidazo [1,5-A] pyridyin derivatives as aldosterone synthase inhibitors NOVARTIS AG (CH) 2014-03-25 US disclosed
US-20070225232-A1 Tetrahydro-Imidazo [1,5-A] Pyridyin Derivatives as Aldosterone Synthase Inhibitors NOVARTIS AG (CH) 2007-09-27 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-20070225232-A1 Tetrahydro-Imidazo [1,5-A] Pyridyin Derivatives as Aldosterone Synthase Inhibitors CYP21A2, CYP11B1, REN CYP17A1 5/4885CYP19A1 54/4885SLC6A2 3339/4885

“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.