SCHEMBL23777965

SCHEMBL23777965

CCCCC(O)CC(=O)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 8/20 0.59
FFAR1 O14842 2/20 0.47
FFAR4 Q5NUL3 1/20 0.47
NFKB1 P19838 1/20 0.46
CA2 P00918 3/20 0.43
MAPK1 P28482 1/20 0.43
ACHE P22303 1/20 0.43
BACE1 P56817 1/20 0.43
HAO1 Q9UJM8 1/20 0.39

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
SCHEMBL23777972 0.86 GPR84 (0.47) GPR84FFAR1FFAR4NFKB1HAO1
SCHEMBL23616659 0.86 GPR84 (0.47) GPR84FFAR1FFAR4NFKB1HAO1
SCHEMBL2168606 0.82 GPR84 (0.83) GPR84FFAR1FFAR4CA2MAPK1
SCHEMBL8074542 0.82 GPR84 (0.83) GPR84FFAR1FFAR4CA2MAPK1
SCHEMBL239580 0.82 GPR84 (0.83) GPR84FFAR1FFAR4CA2MAPK1
Oxalic Acid SCHEMBL28460722 0.81 FFAR1 (0.59) GPR84FFAR1FFAR4NFKB1CA2
SCHEMBL2486550 0.79 GPR84 (0.55) GPR84FFAR1FFAR4NFKB1CA2
SCHEMBL10959756 0.78 NFKB1 (0.55) GPR84FFAR1FFAR4NFKB1CA2
SCHEMBL285410 0.78 CPB2 (0.41) GPR84NFKB1
SCHEMBL21552081 0.78 GPR84 (0.84) GPR84FFAR1FFAR4NFKB1

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
EP-3875590-A1 METHOD FOR PRODUCING ORGANIC COMPOUND AND CORYNEFORM BACTERIUM Green Earth Institute Co., Ltd. (JP) 2021-09-08 EP disclosed
CN-111315888-A Method for producing organic compound and coryneform bacterium 绿色地球研究所株式会社 2020-06-19 CN disclosed