SCHEMBL6780506

SCHEMBL6780506

CCOCc1nc2c(N)nc(C)cc2n1CCCCNS(=O)(=O)c1ccc(OC)cc1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.46
PKM P14618 1/20 0.46
USP2 O75604 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
HTR7 P34969 5/20 0.39
THRB P10828 1/20 0.38
RECQL P46063 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
POLB P06746 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
TLR7 Q9NYK1 1/20 0.37
CYP24A1 Q07973 1/20 0.36
HTR1A P08908 1/20 0.36
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36

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
SCHEMBL6784556 0.91 TLR7 (0.40) ALDH1A1PKMUSP2MEN1KMT2A
SCHEMBL6777494 0.91 DRD2 (0.39) ALDH1A1PKMHTR7TLR7HTR2A
SCHEMBL6779376 0.88 HTR7 (0.38) ALDH1A1HTR7SMN1; SMN2POLBTLR7
SCHEMBL6780023 0.88 TLR7 (0.42) ALDH1A1PKMUSP2MEN1KMT2A
SCHEMBL6774083 0.86 TLR7 (0.40) TLR7
SCHEMBL6773764 0.85 TLR7 (0.38) ALDH1A1KMT2AHTR7SMN1; SMN2POLB
SCHEMBL6285276 0.85 F2 (0.35) ALDH1A1MEN1KMT2APOLBTLR7
SCHEMBL6285270 0.85 F2 (0.35) ALDH1A1MEN1KMT2APOLBTLR7
SCHEMBL6285069 0.85 TLR7 (0.48) TLR7
SCHEMBL6772889 0.83 SMN1; SMN2 (0.48) ALDH1A1MEN1KMT2ASMN1; SMN2

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