SCHEMBL4699427

SCHEMBL4699427

NC(=NN=Cc1cccc2ccccc12)NN=Cc1cccc2ccccc12

nearest known ligand 0.68

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 2/20 0.68
GRIN3B O60391 2/20 0.68
GRIN1 Q05586 2/20 0.68
GRIN2A Q12879 2/20 0.68
GRIN2B Q13224 2/20 0.68
GRIN2C Q14957 2/20 0.68
GRIN3A Q8TCU5 2/20 0.68
MEN1 O00255 7/20 0.57
KMT2A Q03164 7/20 0.57
POLB P06746 1/20 0.57
GCGR P47871 1/20 0.56
ALDH1A1 P00352 1/20 0.53
F2 P00734 1/20 0.53
LMNA P02545 1/20 0.53
NPC1 O15118 4/20 0.53
RAB9A P51151 4/20 0.53
ATM Q13315 1/20 0.51
MAPT P10636 1/20 0.47
CHIA Q9BZP6 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
SCHEMBL4698396 0.92 GRIN2D (0.58) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL17560814 0.81 GRIN2D (1.00) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL17560810 0.81 GRIN2D (1.00) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL19051446 0.80 GUSB (0.68) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL3074694 0.80 GUSB (0.68) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL28149029 0.80 ALDH1A1 (0.65) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL4698450 0.79 MAPT (0.55) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL4697896 0.78 LMNA (0.61) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL4697902 0.78 LMNA (0.61) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL10783548 0.77 LMNA (0.60) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1309544-B1 COMPOUNDS ACTING AS MELANOCORTIN RECEPTOR LIGANDS ACURE PHARMA AB (SE) 2008-11-05 EP claimed
US-7153881-B2 Compounds acting as melanocortin receptor ligands ACURE PHARMA AB (SE) 2006-12-26 US claimed
EP-1309544-B1 COMPOUNDS ACTING AS MELANOCORTIN RECEPTOR LIGANDS ACURE PHARMA AB (SE) 2008-11-05 EP disclosed
US-7153881-B2 Compounds acting as melanocortin receptor ligands ACURE PHARMA AB (SE) 2006-12-26 US disclosed