SCHEMBL13709253

SCHEMBL13709253

NOC(=O)CCc1ccc(OCc2cccc3c2N(C(=O)CCc2cccnc2)CC3)cc1F

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 6/20 0.37
FFAR4 Q5NUL3 1/20 0.37
PTGER4 P35408 2/20 0.36
PTGER2 P43116 2/20 0.36
CYP4F2 P78329 1/20 0.36
CYP4A11 Q02928 1/20 0.36
MAOA P21397 3/20 0.35
MAOB P27338 3/20 0.35
LCK P06239 2/20 0.35
MAPK1 P28482 2/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.35
NPC1 O15118 1/20 0.35
MAPT P10636 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
C3AR1 Q16581 1/20 0.34
CYP11B2 P19099 1/20 0.34
ROCK2 O75116 1/20 0.34

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
SCHEMBL13312507 0.91 FFAR1 (0.44) FFAR1FFAR4PTGER4PTGER2CYP4F2
SCHEMBL13312440 0.85 FFAR1 (0.44) FFAR1FFAR4PTGER4PTGER2CYP11B2
SCHEMBL13312504 0.82 FFAR1 (0.48) FFAR1FFAR4PTGER4PTGER2MAPK1
SCHEMBL13312511 0.79 RXRA (0.42) FFAR1FFAR4PTGER4PTGER2
SCHEMBL13312434 0.75 FFAR1 (0.48) FFAR1FFAR4PTGER4PTGER2
SCHEMBL13312452 0.74 FFAR1 (0.45) FFAR1FFAR4PTGER4PTGER2
SCHEMBL13312510 0.74 FFAR4 (0.48) FFAR1FFAR4PTGER4PTGER2NPC1
SCHEMBL13312441 0.74 FFAR1 (0.43) FFAR1FFAR4PTGER4PTGER2CYP4F2
SCHEMBL13312502 0.74 FFAR1 (0.49) FFAR1FFAR4PTGER4PTGER2
SCHEMBL13312443 0.74 FFAR1 (0.43) FFAR1FFAR4PTGER4PTGER2

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
EP-2096109-A1 CARBOXYLIC ACID DERIVATIVE Astellas Pharma Inc. (JP) 2009-09-02 EP disclosed