SCHEMBL28009302

SCHEMBL28009302

CC(Cc1ccc(F)c(N)c1)C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G10 O15496 3/20 0.42
PLA2G2A P14555 3/20 0.42
PLA2G1B P04054 1/20 0.42
PLA2G5 P39877 1/20 0.42
PLA2G2C Q5R387 1/20 0.42
PLA2G12B Q9BX93 1/20 0.42
PLA2G12A Q9BZM1 1/20 0.42
PLA2G2F Q9BZM2 1/20 0.42
PLA2G3 Q9NZ20 1/20 0.42
PLA2G2E Q9NZK7 1/20 0.42
PLA2G2D Q9UNK4 1/20 0.42
PRSS1 P07477 4/20 0.42
TMPRSS15 P98073 4/20 0.42
TBXAS1 P24557 2/20 0.41
FFAR1 O14842 2/20 0.40
PPARD Q03181 3/20 0.39
PPARA Q07869 3/20 0.39
PTGS1 P23219 3/20 0.38
PTGS2 P35354 3/20 0.38
KDM4E B2RXH2 1/20 0.38

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
SCHEMBL15709334 1.00 PLA2G10 (0.42) PLA2G10PLA2G2APLA2G1BPLA2G5PLA2G2C
SCHEMBL15709740 1.00 PLA2G10 (0.42) PLA2G10PLA2G2APLA2G1BPLA2G5PLA2G2C
SCHEMBL6003677 0.85 TBXAS1 (0.44) PLA2G10PLA2G2APLA2G1BPLA2G5PLA2G2C
SCHEMBL31067929 0.85 TBXAS1 (0.44) PLA2G10PLA2G2APLA2G1BPLA2G5PLA2G2C
SCHEMBL6005325 0.85 TBXAS1 (0.44) PLA2G10PLA2G2APLA2G1BPLA2G5PLA2G2C
SCHEMBL6003686 0.85 TBXAS1 (0.44) PLA2G10PLA2G2APLA2G1BPLA2G5PLA2G2C
SCHEMBL13604863 0.82 ALDH1A1 (0.51) PLA2G10PLA2G2APLA2G1BPLA2G5PLA2G2C
SCHEMBL20312144 0.82 ALDH1A1 (0.51) PLA2G10PLA2G2APLA2G1BPLA2G5PLA2G2C
SCHEMBL6901708 0.82 EPHX2 (0.41) KDM4EALOX15HSD17B10
SCHEMBL1930974 0.82 EPHX2 (0.41) KDM4EALOX15HSD17B10

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
CN-104470895-B The purposes of N [3 (2 carboxy ethyl) phenyl] piperidinyl-1 yl acetamide derivatives and its activator as soluble guanylate cyclase 拜耳制药股份公司 2017-04-05 CN disclosed
CN-104470895-A N-[3-(2-carboxyethyl)phenyl]piperidin-1-ylacetamide derivatives and use thereof as activators of soluble guanylate cyclase Bayer Pharma AG 2015-03-25 CN disclosed