SCHEMBL29007017

SCHEMBL29007017

CC(CC(CCNC(=O)CCC(=O)O)Cc1ccc(-c2ccccc2)cc1)C(=O)O

nearest known ligand 0.65

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MME P08473 13/20 0.65
ACE P12821 8/20 0.65
MMEL1 Q495T6 2/20 0.53

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
SCHEMBL7438041 0.81 MME (0.59) MMEACEMMEL1
Lbq-657 SCHEMBL1908575 0.79 MME (1.00) MMEACEMMEL1
Lbq-657 SCHEMBL391633 0.79 MME (1.00) MMEACEMMEL1
Lbq-657 SCHEMBL7433849 0.79 MME (1.00) MMEACEMMEL1
Lbq-657 SCHEMBL489122 0.79 MME (1.00) MMEACEMMEL1
Lbq-657 SCHEMBL9565416 0.79 MME (1.00) MMEACEMMEL1
SCHEMBL28578516 0.78 MME (0.65) MMEACEMMEL1
SCHEMBL18591 0.77 MME (0.64) MMEACEMMEL1
SCHEMBL9565402 0.77 MME (0.64) MMEACEMMEL1
SCHEMBL28576487 0.76 MME (0.48) MMEACE

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-108794342-B Ammonium carboxylate compound, crystal form and amorphous form thereof and preparation method thereof 武汉朗来科技发展有限公司 2023-04-14 CN disclosed