SCHEMBL926257

SCHEMBL926257

CSc1ncn(C)c1C(N)=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APOBEC3A P31941 4/20 0.38
APOBEC3G Q9HC16 3/20 0.38
PDPK1 O15530 1/20 0.38
PLK4 O00444 1/20 0.35
ROCK2 O75116 1/20 0.35
RPS6KA5 O75582 1/20 0.35
MAP4K4 O95819 1/20 0.35
INSR P06213 1/20 0.35
ROS1 P08922 1/20 0.35
PIM1 P11309 1/20 0.35
PHKG2 P15735 1/20 0.35
PRKACA P17612 1/20 0.35
RPS6KB1 P23443 1/20 0.35
AKT1 P31749 1/20 0.35
FLT3 P36888 1/20 0.35
CSNK1D P48730 1/20 0.35
CLK2 P49760 1/20 0.35
IRAK1 P51617 1/20 0.35
CDK5 Q00535 1/20 0.35
MAP4K2 Q12851 1/20 0.35

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
SCHEMBL8304800 0.83 APOBEC3A (0.39) APOBEC3AAPOBEC3GMEN1KMT2ALMNA
SCHEMBL2202785 0.79 APOBEC3A (0.41) APOBEC3AAPOBEC3GMKNK2MEN1KMT2A
SCHEMBL13651663 0.75 APOBEC3A (0.41) APOBEC3AAPOBEC3GMEN1KMT2APABPC1
SCHEMBL13030147 0.75 APOBEC3A (0.49) APOBEC3AAPOBEC3GMEN1KMT2APABPC1
SCHEMBL19797901 0.75 APOBEC3A (0.41) APOBEC3AAPOBEC3GPIM3MKNK2MEN1
SCHEMBL28415122 0.73 APOBEC3A (0.40) APOBEC3AAPOBEC3GMEN1KMT2APABPC1
SCHEMBL1665829 0.70 APOBEC3A (0.38) APOBEC3AAPOBEC3GMKNK2MEN1KMT2A
SCHEMBL18256648 0.70 YTHDC1 (0.40) APOBEC3AAPOBEC3GMEN1KMT2APABPC1
SCHEMBL11760109 0.68 KDM4E (0.54) KMT2AKDM4EALDH1A1LMNA
SCHEMBL25809566 0.67 APOBEC3A (0.38) APOBEC3AAPOBEC3GMEN1KMT2APABPC1

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-7871488-B2 Waterborne adhesive HENKEL AG & CO. KGAA (DE) 2011-01-18 US disclosed
US-20080146710-A1 Waterborne adhesive HENKEL AG & CO. KGAA (DE) 2008-06-19 US disclosed