SCHEMBL6773093

SCHEMBL6773093

Cc1nc(N)c2nc(C)n(CCNC(=O)Cc3ccccc3)c2c1C

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.51
MEN1 O00255 3/20 0.51
MAPT P10636 2/20 0.51
TLR7 Q9NYK1 2/20 0.43
HSD17B10 Q99714 1/20 0.43
ALDH1A1 P00352 2/20 0.43
GSK3B P49841 1/20 0.41
GAA P10253 1/20 0.40
HPGD P15428 1/20 0.40
ATM Q13315 1/20 0.39
CNR1 P21554 1/20 0.38
TRPV1 Q8NER1 1/20 0.38

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
SCHEMBL6774292 0.94 ALDH1A1 (0.47) KMT2AMEN1MAPTTLR7HSD17B10
SCHEMBL6778680 0.90 HPGD (0.43) KMT2AMEN1MAPTTLR7ALDH1A1
SCHEMBL6774657 0.85 MAPT (0.49) KMT2AMEN1MAPTTLR7ALDH1A1
SCHEMBL6779679 0.84 HPGD (0.46) KMT2AMEN1HSD17B10ALDH1A1HPGD
SCHEMBL6776784 0.83 ALDH1A1 (0.48) KMT2AMEN1TLR7HSD17B10ALDH1A1
SCHEMBL6279157 0.81 TLR7 (0.37) KMT2AMEN1MAPTTLR7ALDH1A1
SCHEMBL6781809 0.81 POLB (0.42) KMT2AMEN1MAPTTLR7ALDH1A1
SCHEMBL6779590 0.81 MAPKAPK2 (0.43) KMT2AMEN1MAPTTLR7ALDH1A1
SCHEMBL6110335 0.81 KDM4E (0.39) TLR7ALDH1A1GAAHPGDCNR1
SCHEMBL6771821 0.80 TLR7 (0.47) KMT2AMEN1MAPTTLR7ALDH1A1

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
US-6720333-B2 IMMUNE RESPONSE MODIFIERS; CYTOKINE BIOSYNTHESIS; VIRAL AND NEOPLASTIC DISEASES; N-(4-(4-AMINO-6,7-DIMETHYL-1H-IMIDAZO (4,5-C)PYRIDIN-1-YL)BUTYL)BENZAMIDE 3M INNOVATIVE PROPERTIES COMPANY 2004-04-13 US claimed