SCHEMBL10102102

SCHEMBL10102102

NC(=O)c1cnn(-c2ccccc2)c1N=Nc1c(N)nc(N)nc1N

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RIPK2 O43353 1/20 0.56
RAB9A P51151 3/20 0.45
NPC1 O15118 1/20 0.45
MAPK14 Q16539 3/20 0.44
SLC9A1 P19634 2/20 0.43
SLC9A2 Q9UBY0 2/20 0.43
LMNA P02545 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
POLB P06746 2/20 0.42
MAPT P10636 1/20 0.42
KMT2A Q03164 1/20 0.42
ATM Q13315 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
RCE1 Q9Y256 1/20 0.41
HPGD P15428 3/20 0.41
MAPK1 P28482 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C19 P33261 1/20 0.41
HSD17B10 Q99714 1/20 0.41
KEAP1 Q14145 1/20 0.40

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
SCHEMBL10101836 1.00 RIPK2 (0.56) RIPK2RAB9ANPC1MAPK14SLC9A1
SCHEMBL12905195 0.93 RIPK2 (0.51) RIPK2RAB9ANPC1MAPK14SLC9A1
SCHEMBL10101821 0.84 RIPK2 (0.49) RIPK2RAB9ANPC1MAPK14SLC9A1
SCHEMBL2743084 0.72 RIPK2 (1.00) RIPK2RAB9ANPC1MAPK14SLC9A1
SCHEMBL11885420 0.72 NQO2 (0.58) RIPK2RAB9ANPC1SMN1; SMN2POLB
SCHEMBL2926133 0.68 MAPK1 (0.73) RIPK2RAB9ANPC1SLC9A1SLC9A2
SCHEMBL30147332 0.68 RIPK2 (0.69) RIPK2RAB9ANPC1MAPK14SLC9A1
SCHEMBL10365977 0.68 RIPK2 (0.63) RIPK2RAB9AMAPK14SLC9A1SLC9A2
SCHEMBL4742583 0.68 RIPK2 (0.40) RIPK2RAB9ANPC1MAPK14SLC9A1
SCHEMBL10332024 0.68 RAB9A (0.48) RIPK2RAB9ANPC1MAPK14SLC9A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8206465-B2 Azo pigments, pigment dispersion, coloring composition, and ink for inkjet recording FUJIFILM CORPORATION (JP) 2012-06-26 US disclosed
US-20110011306-A1 AZO PIGMENTS, PIGMENT DISPERSION, COLORING COMPOSITION, AND INK FOR INKJET RECORDING FUJIFILM CORPORATION (JP) 2011-01-20 US disclosed