SCHEMBL28844222

SCHEMBL28844222

CCCCCCCCCCCCCCCCCC(CCCC(CCC(=O)O)C(=O)O)C(=O)O

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 6/20 0.65
FFAR4 Q5NUL3 2/20 0.56
FFAR1 O14842 2/20 0.56
GRIK1 P39086 1/20 0.56
GRIK2 Q13002 1/20 0.56
GPR84 Q9NQS5 7/20 0.54
PPARG P37231 6/20 0.54
PPARD Q03181 6/20 0.54
PPARA Q07869 6/20 0.54
HDAC11 Q96DB2 5/20 0.54
TSHR P16473 4/20 0.54
ALDH1A1 P00352 2/20 0.54
TLR2 O60603 2/20 0.54
TDP1 Q9NUW8 2/20 0.54
FABP4 P15090 2/20 0.54
PTPN1 P18031 2/20 0.54
SLC22A6 Q4U2R8 1/20 0.54
SLC22A8 Q8TCC7 1/20 0.54
MEN1 O00255 1/20 0.54
ESR1 P03372 1/20 0.54

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
SCHEMBL28282505 1.00 FOLH1 (0.65) FOLH1FFAR4FFAR1GRIK1GRIK2
SCHEMBL27971038 1.00 FOLH1 (0.65) FOLH1FFAR4FFAR1GRIK1GRIK2
SCHEMBL27959752 1.00 FOLH1 (0.65) FOLH1FFAR4FFAR1GRIK1GRIK2
SCHEMBL27971196 1.00 FOLH1 (0.65) FOLH1FFAR4FFAR1GRIK1GRIK2
SCHEMBL28813006 1.00 FOLH1 (0.65) FOLH1FFAR4FFAR1GRIK1GRIK2
SCHEMBL28274788 1.00 FOLH1 (0.65) FOLH1FFAR4FFAR1GRIK1GRIK2
SCHEMBL1506893 0.98 FOLH1 (0.67) FOLH1FFAR4FFAR1GRIK1GRIK2
SCHEMBL3619652 0.98 FOLH1 (0.67) FOLH1FFAR4FFAR1GRIK1GRIK2
SCHEMBL1134819 0.98 FOLH1 (0.67) FOLH1FFAR4FFAR1GRIK1GRIK2
SCHEMBL1506898 0.98 FOLH1 (0.67) FOLH1FFAR4FFAR1GRIK1GRIK2

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-106660943-A Metal/radiometal labeled PSMA inhibitors for PSMA-targeted imaging and radiotherapy 约翰霍普金斯大学 2017-05-10 CN disclosed