SCHEMBL5573331

SCHEMBL5573331

N#Cc1ccc(C2CCCn3cncc32)cc1F

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP17A1 P05093 1/20 0.41
CYP11B1 P15538 11/20 0.40
CYP11B2 P19099 11/20 0.40
IDO1 P14902 1/20 0.38
TDO2 P48775 1/20 0.38
TRPC3 Q13507 2/20 0.38
TRPC6 Q9Y210 2/20 0.38
KDM1A O60341 2/20 0.37
SSTR5 P35346 1/20 0.37
PDE2A O00408 1/20 0.36
DPP4 P27487 1/20 0.36

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
SCHEMBL1180224 0.93 CYP17A1 (0.47) CYP17A1CYP11B1CYP11B2IDO1TDO2
SCHEMBL5569838 0.90 CYP17A1 (0.41) CYP17A1CYP11B1CYP11B2TRPC3TRPC6
SCHEMBL5569827 0.88 CYP17A1 (0.45) CYP17A1CYP11B1CYP11B2DPP4
SCHEMBL5573342 0.86 CYP17A1 (0.45) CYP17A1CYP11B2KDM1A
SCHEMBL1180560 0.84 CYP17A1 (0.36) CYP17A1CYP11B1CYP11B2
SCHEMBL1196282 0.81 CYP17A1 (0.50) CYP17A1CYP11B1CYP11B2
SCHEMBL1768139 0.80 CYP11B1 (0.45) CYP11B1CYP11B2IDO1TDO2
SCHEMBL5133449 0.79 CYP19A1 (0.48) CYP17A1CYP11B1CYP11B2
SCHEMBL5571001 0.79 CYP19A1 (0.48) CYP17A1CYP11B1CYP11B2
SCHEMBL5048062 0.79 CYP19A1 (0.48) CYP17A1CYP11B1CYP11B2

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 5/4885CYP11B1 2/4885CYP11B2 4/4885

“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.