SCHEMBL190163

SCHEMBL190163

Oc1ccc(-c2cc(Cn3ccnc3)on2)cc1

nearest known ligand 0.76

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 10/20 0.76
CYP11B2 P19099 9/20 0.76
CYP19A1 P11511 8/20 0.46
ESR1 P03372 2/20 0.42
ESR2 Q92731 1/20 0.42
CYP17A1 P05093 2/20 0.41
NOTUM Q6P988 1/20 0.41

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
SCHEMBL1219945 0.80 CYP11B1 (0.66) CYP11B1CYP11B2CYP19A1CYP17A1
SCHEMBL190075 0.80 CYP11B1 (0.72) CYP11B1CYP11B2CYP19A1CYP17A1
SCHEMBL189814 0.78 CYP11B1 (0.60) CYP11B1CYP11B2CYP19A1NOTUM
SCHEMBL190093 0.78 CYP11B1 (0.60) CYP11B1CYP11B2CYP19A1
SCHEMBL189507 0.78 CYP11B1 (0.61) CYP11B1CYP11B2CYP19A1
SCHEMBL190083 0.78 CYP11B1 (0.58) CYP11B1CYP11B2CYP19A1
SCHEMBL189288 0.76 CYP11B1 (0.45) CYP11B1CYP11B2NOTUM
SCHEMBL189510 0.76 CYP11B1 (0.59) CYP11B1CYP11B2CYP19A1
SCHEMBL190601 0.76 CYP11B1 (0.56) CYP11B1CYP11B2CYP19A1
SCHEMBL190291 0.73 NOTUM (0.72) CYP11B1NOTUM

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-2401263-B1 SUBSTITUTED AZOLE DERIVATIVES, PHARMACEUTICAL COMPOSITION CONTAINING THE DERIVATIVES, AND METHOD FOR TREATING PARKINSON'S DISEASE USING THE SAME SK BIOPHARMACEUTICALS CO LTD (KR) 2016-02-17 EP disclosed
US-8828992-B2 Substituted azole derivatives, pharmaceutical composition containing the derivatives, and method for treating Parkinson's disease using the same SK BIOPHARMACEUTICALS CO., LTD. (KR) 2014-09-09 US disclosed
EP-2401263-A2 SUBSTITUTED AZOLE DERIVATIVES, PHARMACEUTICAL COMPOSITION CONTAINING THE DERIVATIVES, AND METHOD FOR TREATING PARKINSON'S DISEASE USING THE SAME SK Biopharmaceuticals Co., Ltd. (KR) 2012-01-04 EP disclosed
US-20110301150-A1 SUBSTITUTED AZOLE DERIVATIVES, PHARMACEUTICAL COMPOSITION CONTAINING THE DERIVATIVES, AND METHOD FOR TREATING PARKINSON'S DISEASE USING THE SAME SK BIOPHARMACEUTICALS CO., LTD. 2011-12-08 US disclosed
WO-2010098600-A2 SUBSTITUTED AZOLE DERIVATIVES, PHARMACEUTICAL COMPOSITION CONTAINING THE DERIVATIVES, AND METHOD FOR TREATING PARKINSON'S DISEASE USING THE SAME SK HOLDINGS CO., LTD. (KR) 2010-09-02 WO 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-20110301150-A1 SUBSTITUTED AZOLE DERIVATIVES, PHARMACEUTICAL COMPOSITION CONTAINING THE DERIVATIVES, AND METHOD FOR TREATING PARKINSON'S DISEASE USING THE SAME MAOB, MAOA, PARK7 CYP11B1 6/4885CYP11B2 7/4885CYP19A1 81/4885

“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.