SCHEMBL28837644

SCHEMBL28837644

C=C(C)C(=O)OC(CC)C(CCCC(=O)O)C(=O)O

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.32
FFAR4 Q5NUL3 2/20 0.32
FFAR1 O14842 2/20 0.32
AKR1B1 P15121 1/20 0.32
CMKLR1 Q99788 1/20 0.31
ALDH1A1 P00352 3/20 0.31
FOLH1 Q04609 1/20 0.31
PPARG P37231 6/20 0.31
PPARD Q03181 6/20 0.31
PPARA Q07869 6/20 0.31
HDAC11 Q96DB2 5/20 0.31
GPR84 Q9NQS5 4/20 0.31
TLR2 O60603 2/20 0.31
TDP1 Q9NUW8 2/20 0.31
FABP4 P15090 2/20 0.31
PTPN1 P18031 2/20 0.31
SLC22A6 Q4U2R8 1/20 0.31
SLC22A8 Q8TCC7 1/20 0.31
MEN1 O00255 1/20 0.31
ESR1 P03372 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
SCHEMBL4448432 0.82 TSHR (0.36) TSHRFFAR4ALDH1A1FOLH1SLC22A6
SCHEMBL28097684 0.81 TDP1 (0.42) TSHRALDH1A1TDP1ALOX15
SCHEMBL28108440 0.79 TSHR (0.37) TSHRFFAR4FFAR1AKR1B1CMKLR1
SCHEMBL19669023 0.77 FFAR4 (0.40) TSHRFFAR4FFAR1ALDH1A1PPARG
SCHEMBL17358274 0.75 FFAR4 (0.54) TSHRFFAR4FFAR1AKR1B1ALDH1A1
SCHEMBL10710811 0.74 TSHR (0.40) TSHRFFAR4AKR1B1ALDH1A1SLC22A6
SCHEMBL610038 0.74 FOLH1 (0.39) FFAR4FOLH1
SCHEMBL27281205 0.73 TSHR (0.41) TSHRALDH1A1
SCHEMBL4908130 0.72 TSHR (0.37) TSHRALDH1A1FOLH1
SCHEMBL17358275 0.71 FFAR4 (0.50) TSHRFFAR4FFAR1AKR1B1ALDH1A1

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
CN-106200265-A Photosensitive resin composition, color filter and preparation method thereof, and liquid crystal display device 奇美实业股份有限公司 2016-12-07 CN disclosed