SCHEMBL22352187

SCHEMBL22352187

COP(=O)(O)OC[C@@H]1C[C@@H](O)[C@H](n2cnc3c(=O)[nH]c(N)nc32)O1

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ TGM2 P21980 1/20 0.59
▸ FUT5 Q11128 1/20 0.57
▸ NT5E P21589 1/20 0.56
▸ POLB P06746 1/20 0.55
▸ P2RY2 P41231 1/20 0.52
▸ P2RY4 P51582 1/20 0.52
▸ P2RY6 Q15077 1/20 0.52
▸ KRAS P01116 4/20 0.52
▸ HINT1 P49773 1/20 0.50
▸ IMPDH2 P12268 2/20 0.49
▸ IMPDH1 P20839 1/20 0.49
▸ PNP P00491 1/20 0.49
▸ DCPS Q96C86 1/20 0.48
▸ TAS1R3 Q7RTX0 2/20 0.48
▸ TAS1R1 Q7RTX1 2/20 0.48
▸ HPRT1 P00492 1/20 0.47

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
Deoxy Adenosinediphosphate SCHEMBL5827749 0.91 TGM2 (0.63) TGM2FUT5NT5EPOLBP2RY2
Deoxy Adenosinediphosphate SCHEMBL5827743 0.91 TGM2 (0.63) TGM2FUT5NT5EPOLBP2RY2
SCHEMBL20442307 0.91 POLB (0.61) TGM2FUT5NT5EPOLBP2RY2
SCHEMBL2922052 0.91 POLB (0.61) TGM2FUT5NT5EPOLBP2RY2
SCHEMBL25552773 0.91 TGM2 (0.60) TGM2FUT5NT5EPOLBP2RY2
SCHEMBL1913809 0.90 TGM2 (0.62) TGM2FUT5NT5EPOLBP2RY2
SCHEMBL25712474 0.90 TGM2 (0.62) TGM2FUT5NT5EPOLBP2RY2
SCHEMBL7065119 0.90 TGM2 (0.62) TGM2FUT5NT5EPOLBP2RY2
SCHEMBL22056008 0.90 FUT5 (0.54) TGM2FUT5NT5EPOLBP2RY2
SCHEMBL22352197 0.89 NT5E (0.58) TGM2FUT5NT5EPOLBP2RY2

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-2020165600-A1 BICYCLIC PEPTIDE LIGAND STING CONJUGATES AND USES THEREOF BICYCLETX LIMITED (GB) 2020-08-20 — — WO disclosed
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