SCHEMBL25584523

SCHEMBL25584523

CCc1ccc(-n2cnc3c2C(=O)OC(C)C3)cc1C

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CYP11B2 P19099 16/20 0.46
▸ MAOA P21397 2/20 0.39
▸ MAOB P27338 1/20 0.38
▸ CYP11B1 P15538 1/20 0.36
▸ PTGS2 P35354 1/20 0.34

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
SCHEMBL25584146 0.83 CYP11B2 (0.47) CYP11B2PTGS2
SCHEMBL25584201 0.71 CYP11B2 (0.55) CYP11B2CYP11B1
SCHEMBL25584444 0.71 CYP11B2 (0.46) CYP11B2MAOAMAOBPTGS2
SCHEMBL25584168 0.66 CYP11B2 (0.49) CYP11B2CYP11B1
SCHEMBL25584114 0.64 CYP11B2 (0.50) CYP11B2CYP11B1
SCHEMBL19012368 0.64 MAPT (0.43) —
SCHEMBL31307575 0.64 CYP11B2 (0.69) CYP11B2CYP11B1
SCHEMBL19012622 0.64 MAPT (0.43) —
SCHEMBL25584589 0.64 CYP11B2 (0.51) CYP11B2PTGS2
SCHEMBL14660566 0.62 MAOA (0.47) MAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230181538-A1 ALDOSTERONE SYNTHASE INHIBITORS FOR TREATING CHRONIC KIDNEY DISEASE BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. 2023-06-15 — — 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-20230181538-A1 ALDOSTERONE SYNTHASE INHIBITORS FOR TREATING CHRONIC KIDNEY DISEASE SLC5A2, SLC5A1, REN CYP11B2 10/4885MAOA 1627/4885MAOB 1470/4885

“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.

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