SCHEMBL8828104

SCHEMBL8828104

O=C(O)c1cc2c(Cl)cc(Cl)cc2[nH]c1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 3/20 0.63
RHEB Q15382 1/20 0.49
GRIN2D O15399 2/20 0.47
GRIN3B O60391 2/20 0.47
GRIN2A Q12879 2/20 0.47
GRIN2B Q13224 2/20 0.47
GRIN2C Q14957 2/20 0.47
GRIN3A Q8TCU5 2/20 0.47
KDM4E B2RXH2 2/20 0.47
ALDH1A1 P00352 1/20 0.47
GAA P10253 1/20 0.47
HSD17B10 Q99714 1/20 0.47
MEN1 O00255 2/20 0.46
CYP2C9 P11712 2/20 0.46
HPGD P15428 2/20 0.46
BLM P54132 2/20 0.46
KMT2A Q03164 2/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2D6 P10635 1/20 0.46
ALOX15 P16050 1/20 0.46

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
SCHEMBL5781992 0.80 EIF4A3 (0.68) GRIN1RHEBKDM4EALDH1A1GAA
SCHEMBL29531428 0.77 GRIN1 (1.00) GRIN1RHEBGRIN2DGRIN3BGRIN2A
SCHEMBL727389 0.77 GRIN1 (1.00) GRIN1RHEBGRIN2DGRIN3BGRIN2A
SCHEMBL8873379 0.75 GRIN1 (0.51) GRIN1GRIN2DGRIN3BGRIN2AGRIN2B
SCHEMBL8654398 0.74 GRIN1 (0.52) GRIN1GRIN2DGRIN3BGRIN2AGRIN2B
SCHEMBL29951318 0.73 GRIN1 (0.50) GRIN1GRIN2DGRIN3BGRIN2AGRIN2B
SCHEMBL9249785 0.73 DAO (0.63) GRIN1GRIN2DGRIN3BGRIN2AGRIN2B
SCHEMBL31422913 0.73 DAO (0.63) GRIN1GRIN2DGRIN3BGRIN2AGRIN2B
SCHEMBL14128774 0.72 GRIA1 (0.53) GRIN1GRIN2DGRIN3BGRIN2AGRIN2B
SCHEMBL8828095 0.72 GRIN1 (0.49) 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-5646132-A TREATING CEREBRAL ISCHEMIA ADIR ET COMPAGNIE (FR) 1997-07-08 US disclosed
US-5536709-A INHIBITORS OF HYPERACTIVATION OF EXCITATORY AMINO ACIDS ADIR ET COMPAGNIE (FR) 1996-07-16 US disclosed