SCHEMBL29280882

SCHEMBL29280882

COCc1ccc(CCC(=O)O)cc1

nearest known ligand 0.65

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 15/20 0.65
FFAR4 Q5NUL3 6/20 0.59
KEAP1 Q14145 1/20 0.57
LMNA P02545 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50

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
SCHEMBL4890043 0.85 FFAR1 (0.58) FFAR1FFAR4KEAP1LMNAL3MBTL1
SCHEMBL69746 0.82 FFAR1 (0.81) FFAR1FFAR4KEAP1LMNAL3MBTL1
SCHEMBL11720060 0.82 CYP4F2 (0.50) FFAR1LMNA
SCHEMBL12197608 0.81 FFAR1 (0.63) FFAR1FFAR4KEAP1LMNAL3MBTL1
Hydrochloric Acid SCHEMBL25264643 0.80 FFAR1 (0.77) FFAR1FFAR4KEAP1LMNAL3MBTL1
SCHEMBL14669043 0.80 FFAR1 (0.61) FFAR1FFAR4KEAP1LMNAL3MBTL1
SCHEMBL30792366 0.80 FFAR1 (0.81) FFAR1FFAR4LMNAL3MBTL1
SCHEMBL1587088 0.80 FFAR1 (0.59) FFAR1FFAR4KEAP1LMNAL3MBTL1
SCHEMBL274471 0.80 FFAR1 (0.81) FFAR1FFAR4LMNAL3MBTL1
Hydroxyphenyl Propionic Acid SCHEMBL28123368 0.79 FFAR1 (0.63) FFAR1FFAR4KEAP1LMNAL3MBTL1

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-117820199-A Amide compound and application thereof in preparation of Sigma2 and 5HT2A inhibitors 瀚远医药有限公司 2024-04-05 CN disclosed