SCHEMBL28835012

SCHEMBL28835012

CCC(N)C1CCCCC1(N)N

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SHBG P04278 1/20 0.31

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
SCHEMBL10537585 0.82 SHBG (0.32) SHBG
SCHEMBL11461026 0.81
SCHEMBL11771027 0.79 SLC6A4 (0.33)
SCHEMBL5789339 0.76
SCHEMBL7563948 0.74
SCHEMBL29077030 0.72
SCHEMBL21197611 0.71
SCHEMBL3124099 0.66
SCHEMBL7517584 0.66 CYP1A2 (0.30)
SCHEMBL2532860 0.64

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115028537-B Preparation method of aminopropyl alicyclic secondary amine 万华化学集团股份有限公司 2023-08-11 CN disclosed
CN-115028537-A Preparation method of aminopropyl alicyclic secondary amine 万华化学集团股份有限公司 2022-09-09 CN disclosed