SCHEMBL8626665

SCHEMBL8626665

Cc1c([N+](=O)[O-])c(O)c(Cl)c2nn[nH]c12

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 6/20 0.35
GRIN3B O60391 6/20 0.35
GRIN1 Q05586 6/20 0.35
GRIN2A Q12879 6/20 0.35
GRIN2B Q13224 6/20 0.35
GRIN2C Q14957 6/20 0.35
GRIN3A Q8TCU5 6/20 0.35
ADORA2A P29274 1/20 0.33
ADORA2B P29275 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
POLB P06746 1/20 0.32
DCTPP1 Q9H773 1/20 0.30

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
SCHEMBL5702736 0.80 IMPDH2 (0.34) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL5702767 0.79 GPR35 (0.33) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL8622456 0.78 TSHR (0.36) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL8101772 0.76 ADORA2A (0.38) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL5702682 0.71 MEN1 (0.38) MEN1KMT2A
SCHEMBL8643113 0.69
SCHEMBL8623917 0.69 GPR35 (0.39) ADORA2AADORA2BMEN1KMT2A
SCHEMBL1019999 0.67 GRIN2D (0.52) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL9952236 0.67 KMT2A (0.43) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL10622786 0.67 KMT2A (0.43) 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2655527-A1 PROCESS FOR CURING SURFACE-COATING COMPOSITIONS ALLNEX AUSTRIA GmbH (AT) 2013-10-30 EP claimed
WO-2012085016-A1 PROCESS FOR CURING SURFACE-COATING COMPOSITIONS CYTEC AUSTRIA GMBH (AT) 2012-06-28 WO claimed
EP-2655527-A1 PROCESS FOR CURING SURFACE-COATING COMPOSITIONS ALLNEX AUSTRIA GmbH (AT) 2013-10-30 EP disclosed
WO-2012085016-A1 PROCESS FOR CURING SURFACE-COATING COMPOSITIONS CYTEC AUSTRIA GMBH (AT) 2012-06-28 WO disclosed
EP-0845026-A1 MULTICOMPONENT SYSTEM FOR USE WITH DETERGENT SUBSTANCES CALL, Hans-Peter Dr. (DE) 1998-06-03 EP disclosed
WO-1997048786-A1 MULTICOMPONENT SYSTEM FOR USE WITH DETERGENT SUBSTANCES CALL HANS PETER (DE) 1997-12-24 WO disclosed