SCHEMBL29005509

SCHEMBL29005509

CC1(C)OB(c2nn(C3CCCO3)c3c(C#N)cccc23)OC1(C)C

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
RET P07949 1/20 0.33
GAA P10253 1/20 0.31
ATR Q13535 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
SCHEMBL25028802 0.97 RET (0.35) RETATR
SCHEMBL25028564 0.82 ESR1 (0.36) RET
SCHEMBL29005831 0.82
SCHEMBL29005634 0.80 CNR1 (0.36) GAA
SCHEMBL29363943 0.77 DGAT2 (0.36) RETGAA
SCHEMBL22258227 0.77 DGAT2 (0.36) RETGAA
SCHEMBL25028803 0.73
SCHEMBL25027592 0.72 RET (0.36) RETATR
SCHEMBL29364183 0.72 RET (0.36) RETATR
SCHEMBL29005738 0.72 LMNA (0.33) GAA

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
CN-115996926-A Indole compounds as androgen receptor modulators 尼多生物科学有限公司 2023-04-21 CN disclosed