SCHEMBL8415895

SCHEMBL8415895

O=c1[nH]c2ccc(S(=O)(=O)N(CCO)CCO)cc2[nH]c1=O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.62
POLB P06746 2/20 0.62
KDM4E B2RXH2 3/20 0.57
TP53 P04637 1/20 0.50
ALDH1A1 P00352 4/20 0.49
GRIN2D O15399 1/20 0.49
GRIN3B O60391 1/20 0.49
GRIN1 Q05586 1/20 0.49
GRIN2A Q12879 1/20 0.49
GRIN2B Q13224 1/20 0.49
GRIN2C Q14957 1/20 0.49
GRIN3A Q8TCU5 1/20 0.49
TAS2R14 Q9NYV8 1/20 0.49
HPGD P15428 2/20 0.48
HSD17B10 Q99714 2/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
VCAM1 P19320 1/20 0.48
RXFP1 Q9HBX9 1/20 0.47

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
SCHEMBL4718577 0.78 RXFP1 (0.49) SMN1; SMN2POLBKDM4EALDH1A1HPGD
SCHEMBL8414074 0.76 KDM4E (0.64) KDM4EALDH1A1TAS2R14HPGDHSD17B10
SCHEMBL18422725 0.74 KDM4E (0.50) POLBKDM4ETP53ALDH1A1GRIN2D
SCHEMBL8413913 0.73 GRIA2 (0.51) KDM4EALDH1A1GRIN2DGRIN3BGRIN1
SCHEMBL11358865 0.73 TAS2R14 (0.61) POLBKDM4EALDH1A1GRIN2DGRIN3B
SCHEMBL11351333 0.73 TAS2R14 (0.61) POLBKDM4EALDH1A1GRIN2DGRIN3B
SCHEMBL3247255 0.73 RXFP1 (0.42) SMN1; SMN2POLBKDM4EALDH1A1HPGD
SCHEMBL11361353 0.72 TAS2R14 (0.59) POLBKDM4EALDH1A1GRIN2DGRIN3B
Potassium SCHEMBL11361366 0.72 TAS2R14 (0.59) POLBKDM4EALDH1A1GRIN2DGRIN3B
SCHEMBL11358859 0.72 TAS2R14 (0.59) POLBKDM4EALDH1A1GRIN2DGRIN3B

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5912245-A AMPA AND KAINATE ANTAGONISTS. EGIS GYOGYSZERGYAR RT. (HU) 1999-06-15 US disclosed
EP-0759910-A1 ACID AMIDE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF EGIS GYOGYSZERGYAR RT. (HU) 1997-03-05 EP disclosed
WO-1995031443-A1 ACID AMIDE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF EGIS Gyógyszergyár Rt. (HU) 1995-11-23 WO disclosed