SCHEMBL7611855

SCHEMBL7611855

Nc1nc2c(ncn2COC2CCCC2CC(O)(O)O)c(=O)[nH]1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PNP P00491 9/20 0.53
▸ BLM P54132 2/20 0.53
▸ HBB P68871 2/20 0.53
▸ USP2 O75604 1/20 0.53
▸ TSHR P16473 1/20 0.53
▸ EDNRA P25101 1/20 0.53
▸ HTR2A P28223 1/20 0.53
▸ RECQL P46063 1/20 0.53
▸ HSD17B10 Q99714 1/20 0.53
▸ MEN1 O00255 2/20 0.52
▸ KMT2A Q03164 2/20 0.52
▸ ALDH1A1 P00352 1/20 0.52
▸ LMNA P02545 1/20 0.52
▸ CYP3A4 P08684 1/20 0.52
▸ NFKB1 P19838 1/20 0.52
▸ VCP P55072 1/20 0.52
▸ SMN1; SMN2 Q16637 1/20 0.52
▸ HIF1A Q16665 1/20 0.52
▸ HPRT1 P00492 3/20 0.50
▸ TK1 P04183 2/20 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
SCHEMBL7614528 0.76 PNP (0.58) PNPBLMHBBUSP2TSHR
SCHEMBL9367676 0.75 TK1 (0.57) PNPBLMHBBUSP2TSHR
Hydrochloric Acid SCHEMBL17186500 0.73 PNP (0.61) PNPBLMHBBUSP2TSHR
SCHEMBL9364800 0.73 TK1 (0.57) PNPBLMHBBUSP2TSHR
SCHEMBL28903585 0.72 PNP (0.61) PNPBLMHBBUSP2TSHR
SCHEMBL9369529 0.72 TK1 (0.56) PNPBLMHBBUSP2TSHR
SCHEMBL9369416 0.72 TK1 (0.56) PNPBLMHBBUSP2TSHR
SCHEMBL10402774 0.71 PNP (0.57) PNPBLMHBBUSP2TSHR
SCHEMBL5443285 0.71 PNP (0.74) PNPBLMHBBUSP2TSHR
SCHEMBL7672450 0.71 PNP (0.63) PNPBLMHBBUSP2TSHR

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
EP-0885224-B1 PROCESS FOR PREPARING GANCICLOVIR DERIVATIVES HOFFMANN LA ROCHE (CH) 2002-12-18 — — EP disclosed
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