SCHEMBL7866085

SCHEMBL7866085

NCCCOC[C@H]1O[C@@H](n2ccc(=O)[nH]c2=O)C[C@@H]1O

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DUT P33316 4/20 0.58
P2RY2 P41231 3/20 0.47
P2RY4 P51582 3/20 0.47
P2RY6 Q15077 2/20 0.47
TYMS P04818 5/20 0.44
LMNA P02545 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL5616449 0.96 DUT (0.56) DUTP2RY2P2RY4P2RY6TYMS
SCHEMBL9670015 0.87 DUT (0.60) DUTP2RY2P2RY4P2RY6TYMS
SCHEMBL10697851 0.87 DUT (0.60) DUTP2RY2P2RY4P2RY6TYMS
SCHEMBL8604517 0.87 DUT (0.55) DUTP2RY2P2RY4P2RY6TYMS
SCHEMBL2056624 0.87 DUT (0.64) DUTP2RY2P2RY4P2RY6TYMS
SCHEMBL2009956 0.87 DUT (0.64) DUTP2RY2P2RY4P2RY6TYMS
SCHEMBL3931458 0.86 DUT (0.55) DUTP2RY2P2RY4P2RY6TYMS
SCHEMBL2242406 0.85 DUT (0.63) DUTP2RY2P2RY4P2RY6TYMS
SCHEMBL1744123 0.84 DUT (0.62) DUTP2RY2P2RY4P2RY6TYMS
SCHEMBL17479412 0.84 DUT (0.62) DUTP2RY2P2RY4P2RY6TYMS

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-6312953-B1 MODIFIED OLIGONUCLEOTIDE COMPLEMENTARY TO A TARGET SEQUENCE AND HAVING AT LEAST TWO CROSSLINKING AGENTS COVALENTLY ATTATCHED; GENE EXPRESSION INHIBITION; DNA SEQUENCING; GENETIC MAPPING EPOCH PHARMACEUTICALS, INC. 2001-11-06 US disclosed