SCHEMBL20954987

SCHEMBL20954987

COc1cc(F)c2c(c1)C(=O)OC21CCN(Cc2ccccc2)CC1

nearest known ligand 0.57

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 3/20 0.55
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ ACHE P22303 1/20 0.45

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
SCHEMBL20955200 0.91 SIGMAR1 (0.47) SIGMAR1
SCHEMBL20955335 0.86 SIGMAR1 (0.51) SIGMAR1
SCHEMBL20954957 0.86 SIGMAR1 (0.51) SIGMAR1
SCHEMBL20955688 0.85 SIGMAR1 (0.60) SIGMAR1
SCHEMBL20955080 0.84 SIGMAR1 (0.49) SIGMAR1ACHE
SCHEMBL20955571 0.84 SIGMAR1 (0.47) SIGMAR1
SCHEMBL20954910 0.84 SIGMAR1 (0.58) SIGMAR1
Hydrochloric Acid SCHEMBL20955046 0.81 SIGMAR1 (0.67) SIGMAR1
SCHEMBL20954922 0.80 SIGMAR1 (0.49) SIGMAR1
SCHEMBL21989233 0.80 SIGMAR1 (0.49) SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11414429-B2 Compound or pharmaceutically acceptable salt thereof RIKEN (JP) 2022-08-16 — — US disclosed
EP-3480198-B1 NOVEL COMPOUND OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF RIKEN (JP) 2021-05-05 — — EP disclosed
US-20200172554-A1 NOVEL COMPOUND OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF RIKEN (JP) 2020-06-04 — — US disclosed
EP-3480198-A1 NOVEL COMPOUND OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF RIKEN (JP) 2019-05-08 — — EP 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-11414429-B2 Compound or pharmaceutically acceptable salt thereof DPP8, DPP7, AZI2 SIGMAR1 863/4885L3MBTL1 4592/4885ACHE 2437/4885
US-20200172554-A1 NOVEL COMPOUND OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF DPP8, DPP7, AZI2 SIGMAR1 526/4885L3MBTL1 4603/4885ACHE 2385/4885

“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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