SCHEMBL783473

SCHEMBL783473

CC(O)c1cncc(-c2cc3c(cc2F)oc(=O)n3C)c1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 7/20 0.54
CYP11B1 P15538 4/20 0.40
GPR55 Q9Y2T6 3/20 0.39
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
KCNJ1 P48048 4/20 0.34
PKM P14618 1/20 0.33
BMPR1B O00238 1/20 0.33
BMPR1A P36894 1/20 0.33
TGFBR1 P36897 1/20 0.33
ACVRL1 P37023 1/20 0.33
ACVR1 Q04771 1/20 0.33
KDM4E B2RXH2 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
SCHEMBL783485 0.81 CYP11B2 (0.43) CYP11B2CYP11B1GPR55MEN1KMT2A
SCHEMBL782371 0.80 CYP11B2 (0.64) CYP11B2CYP11B1GPR55KCNJ1
SCHEMBL805384 0.76 MEN1 (0.43) CYP11B2MEN1KMT2APKM
SCHEMBL782295 0.74 CYP11B2 (0.43) CYP11B2MEN1KMT2APKM
SCHEMBL782484 0.70 CYP11B2 (0.85) CYP11B2GPR55KCNJ1
SCHEMBL24982343 0.68 MEN1 (0.40) CYP11B2GPR55MEN1KMT2APKM
SCHEMBL30912132 0.68 KCNJ1 (0.47) CYP11B2GPR55MEN1KMT2AKCNJ1
SCHEMBL23040019 0.68 KCNJ1 (0.47) CYP11B2GPR55MEN1KMT2AKCNJ1
SCHEMBL24981725 0.68 CTSC (0.38) CYP11B2GPR55MEN1KMT2APKM
SCHEMBL782823 0.67 CYP11B2 (0.58) CYP11B2GPR55KCNJ1

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 CYP11B2 1/4885CYP11B1 2/4885GPR55 852/4885

“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.