SCHEMBL2669833

SCHEMBL2669833

CCCCCC(C)C(Nc1ccc(C(=O)N(C)CCC(=O)O)cc1)c1oc2ccc(OCc3cccnc3)cc2c1C

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.39
CYP4A11 Q02928 1/20 0.39
GPR132 Q9UNW8 9/20 0.38
PLG P00747 1/20 0.35
IGLV6-57 P01721 1/20 0.35
GCG P01275 1/20 0.35
LMNA P02545 1/20 0.35
RECQL P46063 1/20 0.35
PTAFR P25105 2/20 0.35
MAPT P10636 1/20 0.34
ALOX5 P09917 1/20 0.34
PPARG P37231 1/20 0.34
PSEN1 P49768 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
SCHEMBL2669958 0.93 CASP3 (0.39) CYP4F2CYP4A11
SCHEMBL2669819 0.92 CYP4F2 (0.36) CYP4F2CYP4A11GCGMAPT
SCHEMBL2669904 0.90 CYP4F2 (0.34) CYP4F2CYP4A11GCGMAPT
SCHEMBL13069673 0.89 CYP4F2 (0.36) CYP4F2CYP4A11GCGLMNA
SCHEMBL2669782 0.88 EGFR (0.36) CYP4F2CYP4A11GCG
SCHEMBL9070778 0.86 PTGS2 (0.42) CYP4F2CYP4A11GCG
SCHEMBL2669939 0.86 NPC1 (0.39)
SCHEMBL2669836 0.85 NPC1 (0.33) GCG
SCHEMBL9070786 0.85 NPC1 (0.37)
SCHEMBL2669955 0.84 ESR1 (0.39)

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
WO-2009110520-A1 HETEROCYCLIC COMPOUND 武田薬品工業株式会社 (JP) 2009-09-11 WO disclosed