SCHEMBL7359339

SCHEMBL7359339

Cc1ccc2c(c1)[nH]c(=O)c(=O)n2C

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 3/20 0.57
GRIA2 P42262 3/20 0.57
GRIA3 P42263 3/20 0.57
GRIA4 P48058 3/20 0.57
DAO P14920 4/20 0.53
DDO Q99489 1/20 0.45
ADORA2A P29274 1/20 0.42
ADORA2B P29275 1/20 0.42
PARG Q86W56 1/20 0.41
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 2/20 0.40
HSD17B10 Q99714 2/20 0.40
PDE2A O00408 1/20 0.40
PDE3B Q13370 1/20 0.40
PDE3A Q14432 1/20 0.40
NOS3 P29474 1/20 0.40
NOS1 P29475 1/20 0.40
NOS2 P35228 1/20 0.40
GRIN2D O15399 2/20 0.39
GRIN3B O60391 2/20 0.39

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
SCHEMBL5545573 0.86 GRIA1 (0.57) GRIA1GRIA2GRIA3GRIA4DAO
SCHEMBL3263393 0.81 DAO (0.66) DAOADORA2AADORA2BPDE2APDE3B
SCHEMBL9365003 0.81 DAO (0.70) GRIA1GRIA2GRIA3GRIA4DAO
SCHEMBL31439104 0.81 GRIA1 (0.60) GRIA1GRIA2GRIA3GRIA4PARG
SCHEMBL5550237 0.81 GRIA1 (0.56) GRIA1GRIA2GRIA3GRIA4DAO
SCHEMBL9398023 0.81 GRIA1 (0.65) GRIA1GRIA2GRIA3GRIA4DAO
SCHEMBL8403660 0.81 GRIA1 (0.60) GRIA1GRIA2GRIA3GRIA4PARG
SCHEMBL7968233 0.81 GRIA1 (0.56) GRIA1GRIA2GRIA3GRIA4PARG
Hydrochloric Acid SCHEMBL9395721 0.79 GRIA1 (0.58) GRIA1GRIA2GRIA3GRIA4PARG
SCHEMBL9395591 0.78 GRIA1 (0.53) GRIA1GRIA2GRIA3GRIA4KDM4E

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-6057304-A Quinoxaline-phosphonic acid derivatives SCHERING AKTIENGESELLSCHAFT (DE) 2000-05-02 US disclosed