SCHEMBL6281783

SCHEMBL6281783

CC(CO[PH](=O)OCC(C)c1ccccc1)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 3/20 0.47
AOC3 Q16853 2/20 0.42
TRPA1 O75762 4/20 0.41
RIPK1 Q13546 1/20 0.41
MAOA P21397 3/20 0.38
MAOB P27338 3/20 0.38
NISCH Q9Y2I1 3/20 0.38
IGLV6-57 P01721 1/20 0.38
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.36

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
SCHEMBL2820605 0.85 TAAR1 (0.44) TAAR1AOC3TRPA1RIPK1ALDH1A1
SCHEMBL3887654 0.81 CA12 (0.42) TAAR1
SCHEMBL31491511 0.77 CCR5 (0.41) TAAR1
SCHEMBL3632312 0.76 TAAR1 (0.56) TAAR1AOC3TRPA1RIPK1ALDH1A1
SCHEMBL585216 0.76 TAAR1 (0.56) TAAR1AOC3TRPA1RIPK1ALDH1A1
SCHEMBL28141975 0.76 SCN4A (0.55)
SCHEMBL12282802 0.74 TAAR1 (0.54) TAAR1AOC3TRPA1RIPK1ALDH1A1
SCHEMBL2093765 0.74 TAAR1 (0.54) TAAR1AOC3TRPA1RIPK1ALDH1A1
SCHEMBL1911097 0.74 TAAR1 (0.54) TAAR1AOC3TRPA1RIPK1ALDH1A1
SCHEMBL8905041 0.73 TAAR1 (0.48) TAAR1AOC3TRPA1RIPK1IGLV6-57

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
CN-119930871-A Catalyst for olefin polymerization and preparation method and application thereof 中国石油天然气股份有限公司 2025-05-06 CN claimed
CN-119930871-A Catalyst for olefin polymerization and preparation method and application thereof 中国石油天然气股份有限公司 2025-05-06 CN disclosed
US-20050038144-A1 Flame retardant phosphonate additives for thermoplastics RHODIA OPERATIONS (FR) 2005-02-17 US disclosed