SCHEMBL8077580

SCHEMBL8077580

CCC(Cl)OC(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.38
KCNN4 O15554 2/20 0.36
MAPK1 P28482 1/20 0.35
TSHR P16473 1/20 0.34
GRIN1 Q05586 6/20 0.33
GRIN2A Q12879 6/20 0.33
GRIN2D O15399 5/20 0.33
GRIN2C Q14957 5/20 0.33
GRIN2B Q13224 4/20 0.33
LMNA P02545 1/20 0.33
TAAR1 Q96RJ0 1/20 0.33
ALDH1A1 P00352 1/20 0.33
ALOX15 P16050 1/20 0.33
OPRM1 P35372 3/20 0.33
DRD3 P35462 2/20 0.33
CACNA1F O60840 1/20 0.33
ABCB1 P08183 1/20 0.33
CYP2B6 P20813 1/20 0.33
DRD4 P21917 1/20 0.33
OPRD1 P41143 1/20 0.33

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
SCHEMBL9752682 0.76 KIF11 (0.42) KIF11KCNN4MAPK1GRIN1GRIN2A
SCHEMBL16551069 0.76 LMNA (0.42) KIF11KCNN4MAPK1TSHRGRIN1
SCHEMBL4759816 0.75 CYP2C19 (0.40) KIF11KCNN4GRIN1GRIN2AGRIN2D
SCHEMBL4544072 0.72 TSHR (0.39) KIF11KCNN4MAPK1TSHRALDH1A1
SCHEMBL4367368 0.72 MAPK1 (0.42) KIF11KCNN4MAPK1TSHRTAAR1
SCHEMBL28962449 0.71 KIF11 (0.34) KIF11KCNN4MAPK1GRIN1GRIN2A
SCHEMBL28227393 0.71 TRPA1 (0.40) KIF11MAPK1GRIN1GRIN2AGRIN2D
SCHEMBL11503548 0.69 KIF11 (0.33) KIF11KCNN4MAPK1
SCHEMBL11346882 0.69 KIF11 (0.33) KIF11KCNN4MAPK1TSHR
SCHEMBL4011121 0.69 KIF11 (0.36) KIF11KCNN4MAPK1TSHRLMNA

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-1028982-A1 COMPOSITIONS PROVIDING IMPROVED FUNCTIONALIZATION OF TERMINAL ANIONS AND PROCESSES FOR IMPROVED FUNCTIONALIZATION OF TERMINAL ANIONS FMC CORPORATION (US) 2000-08-23 EP disclosed
WO-1999025740-A1 COMPOSITIONS PROVIDING IMPROVED FUNCTIONALIZATION OF TERMINAL ANIONS AND PROCESSES FOR IMPROVED FUNCTIONALIZATION OF TERMINAL ANIONS FMC CORPORATION (US) 1999-05-27 WO disclosed