SCHEMBL25964115

SCHEMBL25964115

Nc1nc2c(ncn2[C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O[C@H]3OC(CNC(=O)CCOCCOCCOCCOCCNC(=O)OC[C@@H]4[C@@H]5CCC#CCC[C@@H]54)[C@@H](O)C(O)C3O)C[C@@H]2O)c(=O)[nH]1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KRAS P01116 14/20 0.49
FUT5 Q11128 1/20 0.47
TGM2 P21980 1/20 0.45
FUT6 P51993 1/20 0.41
P2RY2 P41231 1/20 0.41
P2RY4 P51582 1/20 0.41
P2RY6 Q15077 1/20 0.41
HINT1 P49773 2/20 0.41

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
SCHEMBL25962160 0.92 KRAS (0.47) KRASFUT5TGM2FUT6P2RY2
SCHEMBL25962089 0.89 FUT5 (0.54) KRASFUT5TGM2FUT6P2RY2
SCHEMBL25898025 0.85 KRAS (0.59) KRASFUT5TGM2FUT6HINT1
SCHEMBL25892915 0.83 KRAS (0.60) KRASFUT5TGM2FUT6HINT1
SCHEMBL25962870 0.82 KRAS (0.48) KRASFUT5TGM2FUT6P2RY2
SCHEMBL25898022 0.81 KRAS (0.58) KRASFUT5TGM2FUT6P2RY2
SCHEMBL25962161 0.81 KRAS (0.58) KRASFUT5TGM2FUT6P2RY2
SCHEMBL25964287 0.81 FUT5 (0.54) KRASFUT5TGM2FUT6P2RY2
SCHEMBL25892795 0.78 KRAS (0.61) KRASFUT5TGM2FUT6P2RY2
SCHEMBL25892798 0.78 KRAS (0.61) KRASFUT5TGM2FUT6P2RY2

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