SCHEMBL23919203

SCHEMBL23919203

CC(C)OCCN1CCN(CCC(C)(C)C)[C@H](C)C1

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.35
KCNJ1 P48048 1/20 0.33
KCNH2 Q12809 1/20 0.33
KDM1A O60341 1/20 0.30
SLC6A4 P31645 1/20 0.30
SLC6A3 Q01959 1/20 0.30

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
SCHEMBL25134153 0.94 SIGMAR1 (0.38) SIGMAR1KCNJ1KCNH2SLC6A4SLC6A3
SCHEMBL25133365 0.94 SIGMAR1 (0.38) SIGMAR1KCNJ1KCNH2SLC6A4SLC6A3
SCHEMBL25133388 0.89 SIGMAR1 (0.33) SIGMAR1KCNJ1KCNH2
SCHEMBL26972455 0.88 SIGMAR1 (0.43) SIGMAR1KCNJ1KCNH2KDM1A
SCHEMBL25133361 0.88 SIGMAR1 (0.43) SIGMAR1KCNJ1KCNH2KDM1A
SCHEMBL23919018 0.84 SIGMAR1 (0.37) SIGMAR1KCNJ1KCNH2KDM1A
SCHEMBL23205219 0.84 SIGMAR1 (0.37) SIGMAR1KCNJ1KCNH2KDM1A
SCHEMBL23267012 0.84 SIGMAR1 (0.37) SIGMAR1KCNJ1KCNH2KDM1A
SCHEMBL23875168 0.82 SIGMAR1 (0.39) SIGMAR1KCNJ1KCNH2KDM1A
SCHEMBL21421602 0.82 KCNH2 (0.34) KCNJ1KCNH2

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
US-11858940-B2 Selective modulators of mutant LRRK2 proteolysis and associated methods of use ARVINAS OPERATIONS, INC. (US) 2024-01-02 US disclosed
US-20230097358-A1 INDAZOLE BASED COMPOUNDS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. 2023-03-30 US disclosed
US-20210315896-A1 INDAZOLE BASED COMPOUNDS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. 2021-10-14 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 (3 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-20210315896-A1 INDAZOLE BASED COMPOUNDS AND ASSOCIATED METHODS OF USE LRRK2, CRBN, MDM2 SIGMAR1 3941/4885KCNJ1 4286/4885KCNH2 4503/4885
US-20230097358-A1 INDAZOLE BASED COMPOUNDS AND ASSOCIATED METHODS OF USE LRRK2, CRBN, MDM2 SIGMAR1 3941/4885KCNJ1 4286/4885KCNH2 4503/4885
US-11858940-B2 Selective modulators of mutant LRRK2 proteolysis and associated methods of use LRRK2, ADRM1, CRBN SIGMAR1 3038/4885KCNJ1 4742/4885KCNH2 4712/4885

“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.