SCHEMBL782548

SCHEMBL782548

CCS(=O)(=O)Nc1cncc(-c2ccc3oc(=O)n(C)c3c2)c1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 3/20 0.48
GPR55 Q9Y2T6 2/20 0.42
KCNJ1 P48048 3/20 0.42
BRPF1 P55201 1/20 0.39
PKM P14618 5/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
LMNA P02545 2/20 0.39
HTT P42858 2/20 0.39
MAPK1 P28482 1/20 0.39
BRD4 O60885 3/20 0.38
MEN1 O00255 1/20 0.38
TSHR P16473 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL783403 0.93 PTPN5 (0.44) CYP11B2GPR55KCNJ1PKMSMN1; SMN2
SCHEMBL805366 0.89 CYP11B2 (0.49) CYP11B2GPR55KCNJ1PKMSMN1; SMN2
SCHEMBL782798 0.88 CYP11B2 (0.43) CYP11B2BRPF1BRD4
SCHEMBL10233229 0.88 PDE10A (0.43) CYP11B2SMN1; SMN2
SCHEMBL805385 0.86 GPR55 (0.46) CYP11B2GPR55KCNJ1BRPF1PKM
SCHEMBL782733 0.84 BRPF1 (0.42) CYP11B2GPR55KCNJ1BRPF1PKM
SCHEMBL783483 0.83 KCNJ1 (0.53) CYP11B2GPR55KCNJ1PKMSMN1; SMN2
SCHEMBL782295 0.82 CYP11B2 (0.43) CYP11B2BRPF1PKMSMN1; SMN2LMNA
SCHEMBL782715 0.78 CYP11B2 (0.53) CYP11B2GPR55BRPF1PKMSMN1; SMN2
SCHEMBL783680 0.77 CYP11B2 (0.47) CYP11B2GPR55KCNJ1LMNATSHR

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 5 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
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

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 CYP11B2 1/4885GPR55 852/4885KCNJ1 630/4885

“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.