SCHEMBL5569827

SCHEMBL5569827

Cc1cc(C2CCCn3cncc32)ccc1C#N

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP17A1 P05093 1/20 0.45
CYP11B2 P19099 8/20 0.42
CYP11B1 P15538 6/20 0.42
USP30 Q70CQ3 1/20 0.39
PIM1 P11309 1/20 0.36
PIM3 Q86V86 1/20 0.36
PIM2 Q9P1W9 1/20 0.36
FNTA P49354 1/20 0.35
FNTB P49356 1/20 0.35
PGGT1B P53609 1/20 0.35
CYP19A1 P11511 7/20 0.34
KCNH2 Q12809 2/20 0.34
PRKDC P78527 1/20 0.34
DPP4 P27487 1/20 0.34
FASN P49327 1/20 0.34
PSEN1 P49768 1/20 0.33
PSEN2 P49810 1/20 0.33
APH1B Q8WW43 1/20 0.33
NCSTN Q92542 1/20 0.33
APH1A Q96BI3 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
SCHEMBL5573331 0.88 CYP17A1 (0.41) CYP17A1CYP11B2CYP11B1DPP4
SCHEMBL5569838 0.85 CYP17A1 (0.41) CYP17A1CYP11B2CYP11B1CYP19A1KCNH2
SCHEMBL1180158 0.84 CYP17A1 (0.39) CYP17A1CYP11B2CYP11B1PIM1PIM3
SCHEMBL1196282 0.83 CYP17A1 (0.50) CYP17A1CYP11B2CYP11B1FNTAFNTB
SCHEMBL5571001 0.81 CYP19A1 (0.48) CYP17A1CYP11B2CYP11B1CYP19A1KCNH2
SCHEMBL5133449 0.81 CYP19A1 (0.48) CYP17A1CYP11B2CYP11B1CYP19A1KCNH2
SCHEMBL5048062 0.81 CYP19A1 (0.48) CYP17A1CYP11B2CYP11B1CYP19A1KCNH2
SCHEMBL5573406 0.81 CYP17A1 (0.44) CYP17A1CYP19A1
SCHEMBL5569832 0.80 DRD2 (0.48) CYP17A1CYP11B2CYP11B1
SCHEMBL1180224 0.80 CYP17A1 (0.47) CYP17A1CYP11B2CYP11B1

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 5/4885CYP11B2 4/4885CYP11B1 2/4885

“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.