SCHEMBL8828079

SCHEMBL8828079

CCc1cc2cc(P(=O)(O)O)c(=O)[nH]c2cc1CC

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 3/20 0.53
GRIN3B O60391 3/20 0.53
GRIN1 Q05586 3/20 0.53
GRIN2A Q12879 3/20 0.53
GRIN2B Q13224 3/20 0.53
GRIN2C Q14957 3/20 0.53
GRIN3A Q8TCU5 3/20 0.53
HSD17B10 Q99714 5/20 0.40
TSHR P16473 3/20 0.40
TP53 P04637 1/20 0.40
DAO P14920 2/20 0.40
DDO Q99489 1/20 0.40
GRIA1 P42261 1/20 0.39
GRIA2 P42262 1/20 0.39
GRIA3 P42263 1/20 0.39
GRIA4 P48058 1/20 0.39
KDM4E B2RXH2 4/20 0.39
ALDH1A1 P00352 3/20 0.39
HPGD P15428 2/20 0.39
CYP1A2 P05177 1/20 0.38

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
SCHEMBL8828084 0.81 GRIN2D (0.48) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL8828097 0.78 DAO (0.37) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL3203267 0.72 DAO (0.58) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL7652701 0.72 KDM4E (0.37) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL8090341 0.71 GRIN2D (1.00) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL6939707 0.71 POLB (0.36) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL7652678 0.71 KDM4E (0.38) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL27548155 0.70 KMT2A (0.36) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL6935464 0.69 PRKAG1 (0.43) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL6939746 0.69 GRIN2D (0.37) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B

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-5646132-A TREATING CEREBRAL ISCHEMIA ADIR ET COMPAGNIE (FR) 1997-07-08 US disclosed