SCHEMBL20156462

SCHEMBL20156462

C=C(CC)c1cc(C)c(Cl)cc1CC

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.33
CD44 P16070 1/20 0.32
GRIN2D O15399 2/20 0.32
GRIN3B O60391 2/20 0.32
GRIN1 Q05586 2/20 0.32
GRIN2A Q12879 2/20 0.32
GRIN2B Q13224 2/20 0.32
GRIN2C Q14957 2/20 0.32
GRIN3A Q8TCU5 2/20 0.32
LMNA P02545 1/20 0.31
SCN9A Q15858 1/20 0.30
MAOA P21397 1/20 0.30
MAOB P27338 1/20 0.30
GAA P10253 1/20 0.30
MAPT P10636 1/20 0.30
AGTR1 P30556 1/20 0.30

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
SCHEMBL18432688 0.78 GABRP (0.43) TSHRLMNAGAA
SCHEMBL18432590 0.74 GAA (0.41) TSHRLMNAGAAMAPTAGTR1
SCHEMBL20156555 0.73 FLT1 (0.48) TSHRLMNAMAPT
SCHEMBL13778905 0.72 GRIN2D (0.47) TSHRCD44GRIN2DGRIN3BGRIN1
SCHEMBL19931606 0.72 CD44 (0.42) TSHRCD44GRIN2DGRIN3BGRIN1
SCHEMBL20156420 0.71 JAK2 (0.31)
SCHEMBL574139 0.71 LMNA (0.48) TSHRCD44GRIN2DGRIN3BGRIN1
SCHEMBL13180246 0.68 CD44 (0.42) TSHRCD44GRIN2DGRIN3BGRIN1
SCHEMBL12811480 0.68 GRIN2D (0.47) TSHRCD44GRIN2DGRIN3BGRIN1
SCHEMBL27386561 0.67 LMNA (0.44) TSHRCD44GRIN2DGRIN3BGRIN1

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
WO-2018089904-A1 HETEROCYCLIC MODULATORS OF LIPID SYNTHESIS 3-V BIOSCIENCES, INC. (US) 2018-05-17 WO disclosed