SCHEMBL783335

SCHEMBL783335

CCN(Cc1ccccc1)Cc1cncc(-c2ccc3oc(=O)n(C)c3c2)c1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KCNJ1 P48048 4/20 0.46
CYP11B2 P19099 1/20 0.41
KMT2A Q03164 2/20 0.41
MAPT P10636 1/20 0.41
THRB P10828 1/20 0.41
ACHE P22303 1/20 0.40
BACE1 P56817 1/20 0.40
POLB P06746 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL783194 0.82 KCNJ1 (0.58) KCNJ1CYP11B2KMT2ASMN1; SMN2
SCHEMBL783487 0.79 KCNJ1 (0.51) KCNJ1CYP11B2
SCHEMBL782500 0.77 KCNJ1 (0.50) KCNJ1CYP11B2
SCHEMBL783483 0.75 KCNJ1 (0.53) KCNJ1CYP11B2KMT2AMAPTSMN1; SMN2
SCHEMBL801469 0.73 GPR55 (0.54) KCNJ1CYP11B2BACE1
SCHEMBL28989385 0.72 KCNJ1 (0.46) KCNJ1CYP11B2
SCHEMBL782951 0.71 CYP19A1 (0.55) CYP11B2BACE1
SCHEMBL782507 0.71 CYP11B2 (0.48) KCNJ1CYP11B2
SCHEMBL783358 0.71 CYP11B2 (0.49) KCNJ1CYP11B2
SCHEMBL10234020 0.71 KCNJ1 (0.49) KCNJ1CYP11B2KMT2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2430018-B1 BENZOXAZOLONE DERIVATIVES AS ALDOSTERONE SYMTHASE INHIBITORS NOVARTIS AG (CH) 2013-07-03 EP disclosed
EP-2430018-B1 BENZOXAZOLONE DERIVATIVES AS ALDOSTERONE SYMTHASE INHIBITORS NOVARTIS AG (CH) 2013-07-03 EP disclosed
US-8455522-B2 Benzoxazolone derivatives as aldosterone synthase inhibitors NOVARTIS AG (CH) 2013-06-04 US disclosed
US-8455522-B2 Benzoxazolone derivatives as aldosterone synthase inhibitors NOVARTIS AG (CH) 2013-06-04 US disclosed
US-8455522-B2 Benzoxazolone derivatives as aldosterone synthase inhibitors NOVARTIS AG (CH) 2013-06-04 US disclosed
US-20120071514-A1 BENZOXAZOLONE DERIVATIVES AS ALDOSTERONE SYNTHASE INHIBITORS NOVARTIS AG (CH) 2012-03-22 US disclosed
US-20120071514-A1 BENZOXAZOLONE DERIVATIVES AS ALDOSTERONE SYNTHASE INHIBITORS NOVARTIS AG (CH) 2012-03-22 US disclosed
US-20120071514-A1 BENZOXAZOLONE DERIVATIVES AS ALDOSTERONE SYNTHASE INHIBITORS NOVARTIS AG (CH) 2012-03-22 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-20120071514-A1 BENZOXAZOLONE DERIVATIVES AS ALDOSTERONE SYNTHASE INHIBITORS CYP11B2, CYP11B1, CYP21A2 KCNJ1 630/4885CYP11B2 1/4885KMT2A 3420/4885

“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.