SCHEMBL20547143

SCHEMBL20547143

CC1(C)Cc2noc(Cc3ccc(C(=O)NCCS(C)(=O)=O)cc3)c2C(=O)O1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CYP11B2 P19099 1/20 0.47
▸ MEN1 O00255 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ LOXL2 Q9Y4K0 1/20 0.35
▸ NR1H4 Q96RI1 1/20 0.34
▸ ALK Q9UM73 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ MAPK14 Q16539 1/20 0.33
▸ RAB9A P51151 2/20 0.32
▸ CA1 P00915 1/20 0.32
▸ CA2 P00918 1/20 0.32
▸ CA9 Q16790 1/20 0.32
▸ NPC1 O15118 1/20 0.32

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
SCHEMBL17987402 0.86 CYP11B2 (0.58) CYP11B2MEN1ALDH1A1KMT2ALOXL2
SCHEMBL17963580 0.81 ALDH1A1 (0.41) MEN1ALDH1A1KMT2ASMN1; SMN2
SCHEMBL17987316 0.80 RAB9A (0.45) CYP11B2MEN1ALDH1A1KMT2ALOXL2
SCHEMBL17987307 0.80 ALDH1A1 (0.41) MEN1ALDH1A1KMT2ASMN1; SMN2RAB9A
SCHEMBL17987359 0.79 MEN1 (0.41) MEN1ALDH1A1KMT2A
SCHEMBL17963592 0.78 MEN1 (0.41) MEN1ALDH1A1KMT2A
SCHEMBL17987295 0.78 ALDH1A1 (0.49) CYP11B2MEN1ALDH1A1KMT2ALOXL2
SCHEMBL17963588 0.76 MEN1 (0.40) CYP11B2MEN1ALDH1A1KMT2AL3MBTL1
SCHEMBL17987357 0.75 ALDH1A1 (0.43) CYP11B2MEN1ALDH1A1KMT2ASMN1; SMN2
SCHEMBL17987308 0.74 CYP11B2 (0.44) CYP11B2MEN1ALDH1A1KMT2A

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-3250569-B1 ALDOSTERONE SYNTHASE INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2019-01-09 — — EP disclosed
US-10131642-B1 Aldosterone synthase inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2018-11-20 — — US disclosed
US-20180312475-A1 ALDOSTERONE SYNTHASE INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2018-11-01 — — 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 (2 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-20180312475-A1 ALDOSTERONE SYNTHASE INHIBITORS CYP21A2, CYP11B1, CYP17A1 CYP11B2 5/4885MEN1 610/4885ALDH1A1 250/4885
US-10131642-B1 Aldosterone synthase inhibitors CYP21A2, CYP11B1, CYP17A1 CYP11B2 5/4885MEN1 610/4885ALDH1A1 250/4885

“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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