SCHEMBL30436730

SCHEMBL30436730

COC(=O)C12CCC(CC1)CC2C(=O)Cl

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
NPSR1 Q6W5P4 1/20 0.32
MAPT P10636 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
SCHEMBL30950334 0.86 ALDH1A1 (0.33) ALDH1A1L3MBTL1NPSR1MAPT
SCHEMBL29966782 0.76 ALDH1A1 (0.33) ALDH1A1L3MBTL1NPSR1MAPT
SCHEMBL15440894 0.76 ALDH1A1 (0.34) ALDH1A1L3MBTL1NPSR1
SCHEMBL11301100 0.76 L3MBTL1 (0.34) ALDH1A1L3MBTL1NPSR1
SCHEMBL3679801 0.76 L3MBTL1 (0.34) ALDH1A1L3MBTL1NPSR1
SCHEMBL5318288 0.76 ALDH1A1 (0.34) ALDH1A1L3MBTL1NPSR1
SCHEMBL31090830 0.76
SCHEMBL30744964 0.74 ALDH1A1 (0.32) ALDH1A1L3MBTL1NPSR1MAPT
SCHEMBL30745037 0.74 CYP4F2 (0.33) ALDH1A1L3MBTL1NPSR1MAPT
SCHEMBL30744974 0.72 ALDH1A1 (0.31) ALDH1A1L3MBTL1NPSR1

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-110177783-B Hormone receptor modulators for the treatment of metabolic conditions and disorders 阿德利克斯股份有限公司 2023-06-06 CN disclosed