SCHEMBL8905863

SCHEMBL8905863

CCCOC(O)(O)n1cnc2c(=O)[nH]c(N)nc21

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PNP P00491 4/20 0.51
▸ BLM P54132 2/20 0.51
▸ USP2 O75604 1/20 0.51
▸ TSHR P16473 1/20 0.51
▸ EDNRA P25101 1/20 0.51
▸ HTR2A P28223 1/20 0.51
▸ RECQL P46063 1/20 0.51
▸ HBB P68871 1/20 0.51
▸ HSD17B10 Q99714 1/20 0.51
▸ MEN1 O00255 3/20 0.48
▸ KMT2A Q03164 3/20 0.48
▸ HPRT1 P00492 5/20 0.47
▸ ALDH1A1 P00352 1/20 0.46
▸ LMNA P02545 1/20 0.46
▸ CYP3A4 P08684 1/20 0.46
▸ NFKB1 P19838 1/20 0.46
▸ VCP P55072 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ HIF1A Q16665 1/20 0.46
▸ TK1 P04183 2/20 0.46

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
SCHEMBL11091666 0.81 XDH (0.49) PNPBLMUSP2TSHREDNRA
SCHEMBL8887755 0.78 TK1 (0.52) PNPBLMUSP2TSHREDNRA
SCHEMBL10775468 0.78 PNP (0.56) PNPBLMUSP2TSHREDNRA
SCHEMBL22260577 0.78 MEN1 (0.49) PNPBLMUSP2TSHREDNRA
SCHEMBL22704545 0.78 MEN1 (0.49) PNPBLMUSP2TSHREDNRA
SCHEMBL22021887 0.77 MEN1 (0.51) PNPBLMUSP2TSHREDNRA
SCHEMBL18769787 0.77 MEN1 (0.51) PNPBLMUSP2TSHREDNRA
SCHEMBL5021598 0.76 XDH (0.55) PNPBLMUSP2TSHREDNRA
SCHEMBL27503506 0.76 PNP (0.53) PNPBLMUSP2TSHREDNRA
SCHEMBL21090694 0.76 MEN1 (0.47) PNPBLMUSP2TSHREDNRA

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
US-5659021-A Chiral glycerol derivatives THE BOARD OF GOVERNORS FOR HIGHER EDUCATION, STATE OF RHODE ISLAND AND PROVIDENCE PLANTATIONS (US) 1997-08-19 — — US disclosed
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