SCHEMBL8169596

SCHEMBL8169596

Cc1ccc2[nH]c(=O)c(=O)[nH]c2c1CNC=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 4/20 0.42
GRIN2D O15399 3/20 0.42
GRIN3B O60391 3/20 0.42
GRIN1 Q05586 3/20 0.42
GRIN2A Q12879 3/20 0.42
GRIN2B Q13224 3/20 0.42
GRIN2C Q14957 3/20 0.42
GRIN3A Q8TCU5 3/20 0.42
KDM4E B2RXH2 4/20 0.38
ALDH1A1 P00352 4/20 0.38
HPGD P15428 2/20 0.38
MAPT P10636 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
GRIA1 P42261 3/20 0.37
GRIA2 P42262 3/20 0.37
GRIA3 P42263 3/20 0.37
GRIA4 P48058 3/20 0.37
TAAR1 Q96RJ0 1/20 0.36
LMNA P02545 3/20 0.35
GAA P10253 2/20 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
SCHEMBL7948487 0.84 HSD17B10 (0.44) HSD17B10GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL8634867 0.74 GRIN2D (0.44) HSD17B10GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL7521972 0.71 KDM4E (0.53) HSD17B10GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL5544512 0.70 ADH1B (0.48) ALDH1A1TAAR1ADH1BADH1CADH1A
SCHEMBL7957683 0.70 GRIN2D (0.50) HSD17B10GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL8037105 0.70 CFB (0.48) HSD17B10GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL20334459 0.69 EZH2 (0.43) KDM4E
SCHEMBL8040463 0.69 CFB (0.50) HSD17B10KDM4EALDH1A1HPGDMAPT
SCHEMBL8037118 0.69 CFB (0.50) HSD17B10KDM4EALDH1A1HPGDMAPT
SCHEMBL8037080 0.68 HSD17B10 (0.38) HSD17B10GRIN2DGRIN3BGRIN1GRIN2A

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
US-6063774-A NERVOUS SYSTEM DISORDERS WARNER-LAMBERT COMPANY (US) 2000-05-16 US disclosed