SCHEMBL28226552

SCHEMBL28226552

CCCC1(C(=O)O)CCC(C(=O)O)CC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 3/20 0.40
GRM2 Q14416 2/20 0.40
GRM3 Q14832 2/20 0.40
GRM4 Q14833 2/20 0.40
LMNA P02545 2/20 0.40
TSHR P16473 2/20 0.40
CYP1A2 P05177 2/20 0.40
ALOX15 P16050 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
GRM8 O00222 1/20 0.40
GRM6 O15303 1/20 0.40
GRM5 P41594 1/20 0.40
MTOR P42345 1/20 0.40
GRM1 Q13255 1/20 0.40
PLCB1 Q9NQ66 1/20 0.40
PLG P00747 1/20 0.35
PLAT P00750 1/20 0.35
RORC P51449 3/20 0.35
APLNR P35414 1/20 0.34
GABRP O00591 1/20 0.34

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
SCHEMBL8976650 0.89 LMNA (0.38) CYP2C19GRM2GRM3GRM4LMNA
SCHEMBL16892274 0.87 GRM2 (0.35) CYP2C19GRM2GRM3GRM4LMNA
SCHEMBL8736020 0.86 S1PR5 (0.36) CYP2C19GRM2GRM3GRM4LMNA
SCHEMBL16887652 0.85 LMNA (0.37) CYP2C19GRM2GRM3GRM4LMNA
SCHEMBL16875354 0.84 CYP2C19 (0.42) CYP2C19GRM2GRM3GRM4LMNA
SCHEMBL16875355 0.84 CYP2C19 (0.42) CYP2C19GRM2GRM3GRM4LMNA
SCHEMBL15111460 0.82 CYP2C19 (0.32) CYP2C19ALDH1A1
SCHEMBL3153596 0.81
SCHEMBL13738211 0.81 CYP2C19 (0.40) CYP2C19GRM2GRM3GRM4LMNA
SCHEMBL9682979 0.80 GRM2 (0.38) CYP2C19GRM2GRM3GRM4LMNA

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-108139669-A PHOTOSENSITIVE RESIN COMPOSITION FOR RELIEF PRINTING ORIGINAL PLATE AND RELIEF PRINTING ORIGINAL PLATE OBTAINED THEREFROM 东洋纺株式会社 2018-06-08 CN disclosed