SCHEMBL6062283

SCHEMBL6062283

COC(=Cc1ccc(OCCN2c3ccccc3Cc3ccccc32)cc1)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PPARG P37231 4/20 0.47
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
MAPT P10636 1/20 0.39
TSHR P16473 1/20 0.39
PPARA Q07869 3/20 0.39
LTA4H P09960 2/20 0.38
S1PR1 P21453 2/20 0.38
S1PR3 Q99500 2/20 0.38
KDM4E B2RXH2 1/20 0.38
PSMB1 P20618 1/20 0.38
PSMB5 P28074 1/20 0.38
PSMB2 P49721 1/20 0.38
RAB9A P51151 1/20 0.38
NPC1 O15118 1/20 0.37

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
SCHEMBL6062282 1.00 PPARG (0.47) PPARGKMT2AMEN1MAPTTSHR
SCHEMBL5606815 0.79 PPARG (0.45) PPARGKMT2AMEN1MAPTLTA4H
SCHEMBL6003755 0.74 PPARA (0.57) PPARGKMT2AMEN1PPARA
SCHEMBL7243640 0.74 POLB (0.46) PPARGKMT2AMEN1MAPTPPARA
SCHEMBL6003752 0.74 PPARA (0.57) PPARGKMT2AMEN1PPARA
SCHEMBL7246632 0.74 POLB (0.46) PPARGKMT2AMEN1MAPTPPARA
SCHEMBL6004647 0.74 PPARA (0.57) PPARGKMT2AMEN1PPARA
SCHEMBL7243645 0.74 POLB (0.46) PPARGKMT2AMEN1MAPTPPARA
SCHEMBL5606675 0.74 GAA (0.46) KMT2AMAPTPPARAS1PR1S1PR3
SCHEMBL5606676 0.74 GAA (0.46) KMT2AMAPTPPARAS1PR1S1PR3

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-1687250-A1 PROCESS FOR PRODUCING OPTICALLY ACTIVE 3-(4-HYDROXYPHENYL)PROPIONIC ACIDS Takasago International Corporation (JP) 2006-08-09 EP disclosed
WO-2005051882-A1 PROCESS FOR PRODUCING OPTICALLY ACTIVE 3-(4-HYDROXYPHENYL)PROPIONIC ACIDS TAKASAGO INTERNATIONAL CORPORATION (JP) 2005-06-09 WO disclosed