SCHEMBL6774343

SCHEMBL6774343

CCOCc1nc2c(N)nc(C)c(C)c2n1CCCNS(=O)(=O)c1ccc(OC)cc1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.44
PKM P14618 1/20 0.44
HTR7 P34969 5/20 0.41
USP2 O75604 1/20 0.41
TLR7 Q9NYK1 1/20 0.39
HTR1A P08908 2/20 0.39
HTR2A P28223 2/20 0.39
HTR2C P28335 2/20 0.39
TLR8 Q9NR97 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
LMNA P02545 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
POLB P06746 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37

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
SCHEMBL6776957 0.91 TLR7 (0.42) ALDH1A1TLR7TLR8SMN1; SMN2L3MBTL1
SCHEMBL6783392 0.90 TLR7 (0.47) ALDH1A1PKMHTR7TLR7TLR8
SCHEMBL6780460 0.89 TLR7 (0.44) ALDH1A1TLR7TLR8SMN1; SMN2LMNA
SCHEMBL6778238 0.88 TLR7 (0.44) ALDH1A1TLR7TLR8MEN1KMT2A
SCHEMBL6775218 0.88 POLB (0.42) ALDH1A1HTR7TLR7HTR1AHTR2A
SCHEMBL6779472 0.88 HTR7 (0.40) HTR7TLR7HTR1AHTR2AHTR2C
SCHEMBL6775204 0.85 ALDH1A1 (0.45) ALDH1A1PKMHTR7USP2TLR7
SCHEMBL6777551 0.84 TLR7 (0.41) TLR7TLR8
SCHEMBL6783636 0.84 TLR7 (0.39) ALDH1A1HTR7TLR7HTR2ATLR8
SCHEMBL6768556 0.83 SMN1; SMN2 (0.49) ALDH1A1TLR7TLR8MEN1KMT2A

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-6696465-B2 INDUCING BIOSYNTHESIS OF CYTOKINES; VIRAL AND NEOPLASTIC DISEASES 3M INNOVATIVE PROPERTIES COMPANY 2004-02-24 US claimed