SCHEMBL6773356

SCHEMBL6773356

Cc1nc(N)c2nc(C)n(CCNC(=O)c3ccc4c(c3)OCO4)c2c1C

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 7/20 0.48
ALDH1A1 P00352 4/20 0.48
RAB9A P51151 7/20 0.48
NPC1 O15118 5/20 0.48
HPGD P15428 6/20 0.47
KMT2A Q03164 3/20 0.45
HTT P42858 1/20 0.45
MCHR1 Q99705 1/20 0.45
MEN1 O00255 1/20 0.44
ALOX15 P16050 1/20 0.44
HSD17B10 Q99714 1/20 0.44
KDM4E B2RXH2 2/20 0.44
MAPT P10636 2/20 0.44
LMNA P02545 1/20 0.44
GAA P10253 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
TP53 P04637 1/20 0.42

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
SCHEMBL6768482 0.83 IDO1 (0.47) SMN1; SMN2ALDH1A1RAB9ANPC1KMT2A
SCHEMBL6774657 0.81 MAPT (0.49) SMN1; SMN2ALDH1A1RAB9ANPC1HPGD
SCHEMBL6768729 0.81 TLR7 (0.47) SMN1; SMN2ALDH1A1RAB9ANPC1HPGD
SCHEMBL6773364 0.80 RXFP1 (0.43) ALDH1A1NPC1HPGDMCHR1KDM4E
SCHEMBL6774081 0.79 RAB9A (0.44) SMN1; SMN2RAB9ANPC1KMT2AMEN1
SCHEMBL6779087 0.79 NOS3 (0.48) ALDH1A1RAB9AHPGDKMT2AMEN1
SCHEMBL6773842 0.79 SMN1; SMN2 (0.50) SMN1; SMN2ALDH1A1RAB9ANPC1HPGD
SCHEMBL6773218 0.78 MCHR1 (0.47) ALDH1A1HPGDMCHR1KDM4EMAPT
SCHEMBL6779944 0.77 HDAC3 (0.48)
SCHEMBL6780394 0.77 TRPV1 (0.47) MCHR1MAPT

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