SCHEMBL805385

SCHEMBL805385

CC(C)S(=O)(=O)Nc1cncc(-c2ccc3oc(=O)n(C)c3c2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR55 Q9Y2T6 3/20 0.46
CYP11B2 P19099 1/20 0.45
KCNJ1 P48048 3/20 0.42
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
BRPF1 P55201 1/20 0.40
PKM P14618 4/20 0.38
GFER P55789 1/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
FGFR1 P11362 1/20 0.36
PGR P06401 1/20 0.36
CHRNA1 P02708 1/20 0.36
CHRNG P07510 1/20 0.36
CHRNB1 P11230 1/20 0.36
CHRNB2 P17787 1/20 0.36
CHRNB4 P30926 1/20 0.36
CHRNA3 P32297 1/20 0.36
CHRNA7 P36544 1/20 0.36
CHRNA4 P43681 1/20 0.36

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
SCHEMBL782715 0.92 CYP11B2 (0.53) GPR55CYP11B2MEN1KMT2ABRPF1
SCHEMBL782548 0.86 CYP11B2 (0.48) GPR55CYP11B2KCNJ1MEN1KMT2A
SCHEMBL805366 0.83 CYP11B2 (0.49) GPR55CYP11B2KCNJ1MEN1KMT2A
SCHEMBL783403 0.83 PTPN5 (0.44) GPR55CYP11B2KCNJ1MEN1KMT2A
SCHEMBL782733 0.83 BRPF1 (0.42) GPR55CYP11B2KCNJ1BRPF1PKM
SCHEMBL782371 0.76 CYP11B2 (0.64) GPR55CYP11B2KCNJ1
SCHEMBL801469 0.75 GPR55 (0.54) GPR55CYP11B2KCNJ1
SCHEMBL782798 0.74 CYP11B2 (0.43) CYP11B2BRPF1
SCHEMBL10233229 0.74 PDE10A (0.43) CYP11B2SMN1; SMN2
SCHEMBL29455568 0.73 CYP11B2 (0.54) GPR55CYP11B2KCNJ1

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
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-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 GPR55 852/4885CYP11B2 1/4885KCNJ1 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.