SCHEMBL3397474

SCHEMBL3397474

N#Cc1cc2c(cc1F)COC21CCn2cncc21

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 1/20 0.33
CYP11B2 P19099 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
SCHEMBL3368111 0.95 CYP11B1 (0.33) CYP11B1CYP11B2
SCHEMBL3368899 0.93 CYP11B1 (0.32) CYP11B1CYP11B2
SCHEMBL3369877 0.91 KDM4E (0.33)
SCHEMBL3368835 0.89 KDM4E (0.32) CYP11B1CYP11B2
SCHEMBL3368990 0.89 CYP11B1 (0.34) CYP11B1CYP11B2
SCHEMBL3401093 0.84 CYP11B1 (0.34) CYP11B1CYP11B2
SCHEMBL3368891 0.83 CYP11B2 (0.33) CYP11B1CYP11B2
SCHEMBL3366305 0.80 CYP17A1 (0.33) CYP11B1CYP11B2
SCHEMBL3366407 0.79 FASN (0.37)
SCHEMBL3365832 0.79 FASN (0.37)

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-8324235-B2 Heterocyclic spiro-compounds NOVARTIS AG (CH) 2012-12-04 US disclosed
EP-2134720-B1 HETEROCYCLIC SPIRO-COMPOUNDS NOVARTIS AG (CH) 2010-10-13 EP disclosed
US-20100144774-A1 HETEROCYCLIC SPIRO-COMPOUNDS NOVARTIS AG (CH) 2010-06-10 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-20100144774-A1 HETEROCYCLIC SPIRO-COMPOUNDS REN, NR3C2, CYP21A2 CYP11B1 4/4885CYP11B2 6/4885

“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.