SCHEMBL6925839

SCHEMBL6925839

Cc1ccc(-c2nc3c(C)nc4ccccc4c3n2CCC2CCNCC2)s1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR4 Q13639 1/20 0.39
NPY1R P25929 3/20 0.38
SLC6A4 P31645 1/20 0.35
TLR7 Q9NYK1 7/20 0.35
TLR8 Q9NR97 2/20 0.35
MERTK Q12866 1/20 0.35
KDM4E B2RXH2 2/20 0.34
POLB P06746 1/20 0.34
KHK P50053 2/20 0.34
NPC1 O15118 1/20 0.33
ALDH1A1 P00352 1/20 0.33
TP53 P04637 1/20 0.33
HPGD P15428 1/20 0.33
NFKB1 P19838 1/20 0.33
RAB9A P51151 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HSD17B10 Q99714 1/20 0.33
ACP1 P24666 1/20 0.33

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
SCHEMBL6923309 0.90 NPY1R (0.40) HTR4NPY1RSLC6A4TLR7TLR8
SCHEMBL6833989 0.89 HTR4 (0.37) HTR4NPY1RSLC6A4TLR7TLR8
SCHEMBL6929021 0.87 KDM4E (0.40) HTR4NPY1RKDM4EPOLBNPC1
SCHEMBL6928192 0.87 HTR4 (0.42) HTR4NPY1RSLC6A4TLR7MERTK
SCHEMBL6923656 0.83 HTR4 (0.38) HTR4NPY1RSLC6A4TLR7TLR8
SCHEMBL6928365 0.82 AVPR2 (0.39) HTR4NPY1RSLC6A4MERTKKDM4E
SCHEMBL6927438 0.82 KDM4E (0.40) HTR4NPY1RSLC6A4TLR7TLR8
SCHEMBL6924876 0.82 HTR4 (0.39) HTR4NPY1RSLC6A4TLR7TLR8
SCHEMBL6924606 0.82 HTR4 (0.39) HTR4NPY1RSLC6A4TLR7TLR8
SCHEMBL6927485 0.82 ALDH1A1 (0.43) HTR4NPY1RKDM4EPOLBNPC1

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-6518265-B1 1H-imidazopyridine derivatives HOKURIKU SEIYAKU CO., LTD. (JP) 2003-02-11 US disclosed
EP-1104764-A1 1H-IMIDAZOPYRIDINE DERIVATIVES HOKURIKU SEIYAKU CO., LTD. (JP) 2001-06-06 EP disclosed