SCHEMBL25964288

SCHEMBL25964288

CCCOCCOCCOCCOCCC(=O)NCC1O[C@H](OP(=O)(O)OP(=O)(O)OC[C@@H]2C[C@H](O)[C@H](Nc3nc(N)[nH]c(=O)c3N)O2)C(O)C(O)[C@@H]1O

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
B4GALT1 P15291 5/20 0.37
FUT5 Q11128 1/20 0.37
KRAS P01116 2/20 0.36
P2RY6 Q15077 4/20 0.34
TGM2 P21980 1/20 0.33
P2RY14 Q15391 8/20 0.33
P2RY2 P41231 2/20 0.32
P2RY4 P51582 1/20 0.32

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
SCHEMBL25962089 0.83 FUT5 (0.54) FUT5KRASP2RY6TGM2P2RY2
SCHEMBL25964115 0.73 KRAS (0.49) FUT5KRASP2RY6TGM2P2RY2
SCHEMBL25962870 0.73 KRAS (0.48) FUT5KRASP2RY6TGM2P2RY2
SCHEMBL25964109 0.72 FUT5 (0.62) FUT5KRASP2RY6TGM2P2RY2
SCHEMBL25898025 0.70 KRAS (0.59) FUT5KRASTGM2
SCHEMBL25892798 0.70 KRAS (0.61) FUT5KRASP2RY6TGM2P2RY2
SCHEMBL25892795 0.70 KRAS (0.61) FUT5KRASP2RY6TGM2P2RY2
SCHEMBL25892983 0.69 KRAS (0.50) B4GALT1FUT5KRASP2RY6TGM2
SCHEMBL25964287 0.69 FUT5 (0.54) FUT5KRASP2RY6TGM2P2RY2
SCHEMBL25892915 0.68 KRAS (0.60) FUT5KRASTGM2

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
WO-2023141856-A1 CD3-TARGETING MULTISPECIFIC ANTIBODY AND USE THEREOF 岩唐生物科技(杭州)有限责任公司 2023-08-03 WO disclosed