SCHEMBL8724710

SCHEMBL8724710

COc1ccc(C(c2ccccc2)(c2ccc(OC)cc2)C(Oc2c[nH]nn2)[C@H]2O[C@@H](n3ccc(=O)[nH]c3=O)[C@H](O)[C@@H]2O)cc1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
P2RY14 Q15391 2/20 0.42
SLC28A1 O00337 1/20 0.38
SLC28A2 O43868 1/20 0.38
SLC29A1 Q99808 1/20 0.38
SLC28A3 Q9HAS3 1/20 0.38
P2RY2 P41231 1/20 0.38
P2RY6 Q15077 1/20 0.38

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
SCHEMBL442715 0.84 P2RY14 (0.48) P2RY14SLC28A1SLC28A2SLC29A1SLC28A3
SCHEMBL7524816 0.80 SLC28A1 (0.47) P2RY14SLC28A1SLC28A2SLC29A1SLC28A3
SCHEMBL8970268 0.79 P2RY14 (0.46) P2RY14SLC28A1SLC28A2SLC29A1SLC28A3
SCHEMBL8678169 0.78 P2RY14 (0.41) P2RY14SLC28A1SLC28A2SLC29A1SLC28A3
SCHEMBL8538694 0.77 P2RY14 (0.44) P2RY14SLC28A1SLC28A2SLC29A1SLC28A3
SCHEMBL6832098 0.77 P2RY14 (0.44) P2RY14SLC28A1SLC28A2SLC29A1SLC28A3
SCHEMBL8210384 0.77 P2RY14 (0.44) P2RY14SLC28A1SLC28A2SLC29A1SLC28A3
SCHEMBL9157699 0.75 SLC28A1 (0.53) P2RY14SLC28A1SLC28A2SLC29A1SLC28A3
SCHEMBL21475705 0.73 P2RY14 (0.43) P2RY14SLC28A1SLC28A2SLC29A1SLC28A3
SCHEMBL442714 0.73 SLC28A1 (0.43) P2RY14SLC28A1SLC28A2SLC29A1SLC28A3

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-5854410-A Oligonucleoside cleavage compounds and therapies GENTA INCORPORATED (US) 1998-12-29 US disclosed
WO-1995026733-A1 OLIGONUCLEOSIDE CLEAVAGE COMPOUNDS AND THERAPIES GENTA INCORPORATED (US) 1995-10-12 WO disclosed