SCHEMBL6208078

SCHEMBL6208078

COc1ccc(CCc2ccc(OCc3ccccc3)cc2)cn1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.60
KMT2A Q03164 2/20 0.60
PABPC1 P11940 1/20 0.60
BCHE P06276 5/20 0.53
ABCB1 P08183 1/20 0.52
LTA4H P09960 1/20 0.51
EPHX2 P34913 1/20 0.51
FFAR1 O14842 2/20 0.50
FFAR4 Q5NUL3 1/20 0.50
MAOB P27338 1/20 0.47
LMNA P02545 1/20 0.47
CYP1A2 P05177 1/20 0.47
PTGS1 P23219 1/20 0.47
SLC6A2 P23975 1/20 0.47
CYP2C19 P33261 1/20 0.47
PTGS2 P35354 1/20 0.47
SLC6A3 Q01959 1/20 0.47
HIF1A Q16665 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47
F2 P00734 1/20 0.47

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
SCHEMBL14486572 0.89 MEN1 (0.50) MEN1KMT2APABPC1ABCB1LTA4H
SCHEMBL5183041 0.86 MEN1 (0.56) MEN1KMT2APABPC1FFAR1MAOB
SCHEMBL9950591 0.86 MEN1 (0.63) MEN1KMT2APABPC1MAOBLMNA
SCHEMBL5182991 0.83 KDM1A (0.48) MEN1KMT2APABPC1MAOBLMNA
SCHEMBL12040599 0.81 TDP1 (0.48) MEN1KMT2AMAOBLMNA
SCHEMBL6208697 0.80 MEN1 (0.64) MEN1KMT2APABPC1MAOB
SCHEMBL6209712 0.79 MEN1 (0.56) MEN1KMT2APABPC1BCHEFFAR1
Formic Acid SCHEMBL27523068 0.78 MEN1 (0.62) MEN1KMT2APABPC1MAOBLMNA
Formic Acid Methyl Ester SCHEMBL27529952 0.78 MEN1 (0.58) MEN1KMT2APABPC1BCHEMAOB
SCHEMBL5183487 0.78 APP (0.56) MEN1KMT2APABPC1MAOB

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-1583749-A1 OXAZOLE DERIVATIVES AS INHIBITORS OF CYCLOOXYGENASE Astellas Pharma Inc. (JP) 2005-10-12 EP disclosed
WO-2004065374-A1 OXAZOLE DERIVATIVES AS INHIBITORS OF CYCLOOXYGENASE ASTELLAS PHARMA INC. (JP) 2004-08-05 WO disclosed