SCHEMBL13624691

SCHEMBL13624691

CCc1cccc(N/C(N)=C(/C=N)C(N)=O)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 8/20 0.49
MAPT P10636 3/20 0.49
GRIN2D O15399 1/20 0.49
GRIN3B O60391 1/20 0.49
GRIN1 Q05586 1/20 0.49
GRIN2A Q12879 1/20 0.49
GRIN2B Q13224 1/20 0.49
GRIN2C Q14957 1/20 0.49
GRIN3A Q8TCU5 1/20 0.49
SMN1; SMN2 Q16637 5/20 0.48
HDAC3 O15379 2/20 0.48
HDAC4 P56524 2/20 0.48
HDAC1 Q13547 2/20 0.48
HDAC7 Q8WUI4 2/20 0.48
HDAC2 Q92769 2/20 0.48
HDAC10 Q969S8 2/20 0.48
HDAC11 Q96DB2 2/20 0.48
HDAC8 Q9BY41 2/20 0.48
HDAC6 Q9UBN7 2/20 0.48
HDAC9 Q9UKV0 2/20 0.48

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
SCHEMBL13624774 0.82 HSD17B10 (0.53) SIGMAR1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL23749844 0.82 HSD17B10 (0.53) SIGMAR1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL13624876 0.79 TGM2 (0.51) SMN1; SMN2HPGDMAPK1KMT2AMEN1
SCHEMBL13624994 0.78 TP53 (0.52) SIGMAR1MAPTSMN1; SMN2KMT2ARAB9A
SCHEMBL14981678 0.78 GAA (0.46) MAPTSMN1; SMN2ALDH1A1GAA
SCHEMBL5031452 0.78 SIGMAR1 (0.60) SIGMAR1MAPTGRIN2DGRIN3BGRIN1
Hydrochloric Acid SCHEMBL8884369 0.76 SIGMAR1 (0.61) SIGMAR1MAPTGRIN2DGRIN3BGRIN1
SCHEMBL14981720 0.76 GPR35 (0.35) MAPTSMN1; SMN2MAPK1KMT2AMEN1
SCHEMBL5543814 0.75 MAPT (0.60) SIGMAR1MAPTGRIN2DGRIN3BGRIN1
SCHEMBL8269124 0.75 SIGMAR1 (0.60) SIGMAR1MAPTGRIN2DGRIN3BGRIN1

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
WO-2009136995-A2 INHIBITORS OF SYK PROTEIN KINASE PORTOLA PHARMACEUTICALS, INC. (US) 2009-11-12 WO disclosed