SCHEMBL20762956

SCHEMBL20762956

COP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(=O)[nH]c(N)nc32)[C@H](O)[C@@H]1OP(=O)(O)OC

nearest known ligand 0.65

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TGM2 P21980 1/20 0.65
▸ NT5E P21589 1/20 0.65
▸ FUT5 Q11128 1/20 0.63
▸ KRAS P01116 8/20 0.59
▸ IMPDH2 P12268 1/20 0.58
▸ IMPDH1 P20839 1/20 0.58
▸ HINT1 P49773 1/20 0.56
▸ TAS1R3 Q7RTX0 1/20 0.55
▸ TAS1R1 Q7RTX1 1/20 0.55
▸ RNASEL Q05823 1/20 0.55
▸ DCPS Q96C86 1/20 0.55
▸ P2RY2 P41231 1/20 0.54
▸ P2RY4 P51582 1/20 0.54
▸ P2RY6 Q15077 1/20 0.54
▸ P2RX3 P56373 1/20 0.54

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
SCHEMBL25070726 0.94 TGM2 (0.66) TGM2NT5EFUT5KRASIMPDH2
SCHEMBL25552773 0.92 TGM2 (0.60) TGM2NT5EFUT5KRASIMPDH2
SCHEMBL12015188 0.91 NT5E (0.60) TGM2NT5EFUT5KRASIMPDH2
SCHEMBL12590132 0.91 NT5E (0.60) TGM2NT5EFUT5KRASIMPDH2
SCHEMBL12646612 0.91 NT5E (0.60) TGM2NT5EFUT5KRASIMPDH2
SCHEMBL18258303 0.91 NT5E (0.77) TGM2NT5EFUT5KRASIMPDH2
SCHEMBL14659957 0.91 NT5E (0.77) TGM2NT5EFUT5KRASIMPDH2
SCHEMBL29160869 0.91 NT5E (0.77) TGM2NT5EFUT5KRASIMPDH2
SCHEMBL27378469 0.91 RNASEL (0.67) TGM2NT5ERNASELP2RY2P2RX3
SCHEMBL20763046 0.90 FUT5 (0.57) TGM2NT5EFUT5KRASIMPDH2

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-2019034866-A1 BICYCLIC PEPTIDE LIGAND STING CONJUGATES AND USES THEREOF Bicyclerd Limited (GB) 2019-02-21 — — WO disclosed
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