SCHEMBL27875271

SCHEMBL27875271

CCCCC1=CC(C)(C(=O)O)CC(C(=O)O)=C1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.35
HPGD P15428 1/20 0.35
HSD17B10 Q99714 1/20 0.35
RARB P10826 1/20 0.33
HCAR2 Q8TDS4 3/20 0.31
HCAR3 P49019 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
MAPT P10636 1/20 0.31
PKM P14618 1/20 0.31
ALOX15 P16050 1/20 0.31
TSHR P16473 1/20 0.31
NFKB1 P19838 1/20 0.31
THPO P40225 1/20 0.31
BLM P54132 1/20 0.31
PMP22 Q01453 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL27387441 0.88 PPARA (0.30) PPARA
SCHEMBL27475943 0.87
SCHEMBL27672788 0.85
SCHEMBL27446644 0.84
SCHEMBL27794981 0.84 CYP26B1 (0.33)
SCHEMBL28805616 0.84
SCHEMBL27678688 0.82
SCHEMBL28124927 0.81
SCHEMBL27697642 0.81
SCHEMBL27448536 0.80

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104860826-A Production of substituted phenylene aromatic diesters DOW GLOBAL TECHNOLOGIES LLC 2015-08-26 CN disclosed
CN-102741215-B Production of substituted phenylene aromatic diesters DOW GLOBAL TECHNOLOGIES INC 2015-04-29 CN disclosed
CN-102741215-A Production of substituted phenylene aromatic diesters DOW GLOBAL TECHNOLOGIES INC 2012-10-17 CN disclosed