SCHEMBL5573368

SCHEMBL5573368

c1ccc2c(C3CCCn4cncc43)coc2c1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 1/20 0.49
CHRNA4 P43681 1/20 0.49
DRD2 P14416 13/20 0.41
SLC6A4 P31645 2/20 0.41
SLC6A2 P23975 1/20 0.41
SLC6A3 Q01959 1/20 0.41
CHRM2 P08172 1/20 0.35
CHRM4 P08173 1/20 0.35
CHRM5 P08912 1/20 0.35
CHRM1 P11229 1/20 0.35
CHRM3 P20309 1/20 0.35
HTR2A P28223 12/20 0.34
DRD3 P35462 12/20 0.34
PDE2A O00408 1/20 0.33
NPC1 O15118 1/20 0.32
ALDH1A1 P00352 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 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
SCHEMBL1180595 0.74 CYP17A1 (0.41) CHRNB2CHRNA4CHRM2CHRM4CHRM5
SCHEMBL5574210 0.69 FGFR1 (0.34) ALDH1A1
SCHEMBL3380288 0.68 CYP11B2 (0.58) CHRNB2CHRNA4
SCHEMBL5570925 0.68 CYP1A2 (0.38) HTR2A
SCHEMBL1180209 0.68 CYP17A1 (0.41) CHRNB2CHRNA4ALDH1A1
SCHEMBL5573336 0.67 CYP17A1 (0.43) CHRNB2CHRNA4ALDH1A1
SCHEMBL4724470 0.67 CYP11B2 (0.52) CHRM3
SCHEMBL5573406 0.66 CYP17A1 (0.44) CHRNB2CHRNA4SLC6A4SLC6A2SLC6A3
SCHEMBL5572854 0.66 CYP19A1 (0.43)
SCHEMBL5573376 0.66 CYP17A1 (0.42) CHRNB2

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 3 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 claimed
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 CHRNB2 1959/4885CHRNA4 2112/4885DRD2 4023/4885

“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.