SCHEMBL8924304

SCHEMBL8924304

O=c1[nH]c2cc(Cl)cc(Cl)c2c(O)c1SCCCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 3/20 0.46
GRIN2D O15399 2/20 0.46
GRIN3B O60391 2/20 0.46
GRIN2A Q12879 2/20 0.46
GRIN2B Q13224 2/20 0.46
GRIN2C Q14957 2/20 0.46
GRIN3A Q8TCU5 2/20 0.46
GPR84 Q9NQS5 3/20 0.45
EEF2K O00418 1/20 0.43
PLK4 O00444 1/20 0.43
IKBKB O14920 1/20 0.43
DYRK3 O43781 1/20 0.43
PIM1 P11309 1/20 0.43
CDK2 P24941 1/20 0.43
AKT1 P31749 1/20 0.43
AKT2 P31751 1/20 0.43
CLK2 P49760 1/20 0.43
GSK3B P49841 1/20 0.43
IRAK1 P51617 1/20 0.43
RPS6KA3 P51812 1/20 0.43

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
SCHEMBL8921234 0.91 GRIN2D (0.42) GRIN1GRIN2DGRIN3BGRIN2AGRIN2B
SCHEMBL8921936 0.90 GRIN2D (0.44) GRIN1GRIN2DGRIN3BGRIN2AGRIN2B
SCHEMBL8919961 0.90 GRIN1 (0.44) GRIN1GRIN2AGPR84KDM4EKDM6B
SCHEMBL8922650 0.89 MRGPRX4 (0.43) GRIN1GRIN2DGRIN3BGRIN2AGRIN2B
SCHEMBL8923061 0.87 GRIN1 (0.44) GRIN1GRIN2DGRIN3BGRIN2AGRIN2B
SCHEMBL8922882 0.87 GRIN2D (0.44) GRIN1GRIN2DGRIN3BGRIN2AGRIN2B
SCHEMBL8921159 0.86 GRIN2D (0.42) GRIN1GRIN2DGRIN3BGRIN2AGRIN2B
SCHEMBL8922056 0.86 GRIN1 (0.50) GRIN1GRIN2DGRIN3BGRIN2AGRIN2B
SCHEMBL8922553 0.86 GRIN2D (0.44) GRIN1GRIN2DGRIN3BGRIN2AGRIN2B
SCHEMBL8923576 0.85 CYP4A11 (0.40) GRIN1GRIN2DGRIN3BGRIN2AGRIN2B

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
US-5633379-A N-METHYLASPARTIC ACID ANTAGONIST CIBA-GEIGY CORPORATION (US) 1997-05-27 US claimed
US-5633379-A N-METHYLASPARTIC ACID ANTAGONIST CIBA-GEIGY CORPORATION (US) 1997-05-27 US disclosed