SCHEMBL27361055

SCHEMBL27361055

O=c1[nH]c(=O)c2ncn([C@@H](CO)OC(CO)CO)c2[nH]1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.39
▸ BLM P54132 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ NFKB1 P19838 1/20 0.39
▸ VCP P55072 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ HIF1A Q16665 1/20 0.39
▸ PNP P00491 2/20 0.37
▸ AHCY P23526 3/20 0.36
▸ HSD17B10 Q99714 2/20 0.34
▸ POLB P06746 1/20 0.34
▸ HPRT1 P00492 2/20 0.34
▸ PDE3A Q14432 1/20 0.32
▸ USP2 O75604 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ EDNRA P25101 1/20 0.31
▸ HTR2A P28223 1/20 0.31

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
SCHEMBL10001264 0.72 MEN1 (0.45) ALDH1A1MEN1KMT2ASMN1; SMN2PNP
SCHEMBL28976276 0.72 PNP (0.39) ALDH1A1PNPHPRT1
SCHEMBL7530556 0.70 PNP (0.57) ALDH1A1BLMMEN1LMNACYP3A4
SCHEMBL24263987 0.69 BLM (0.56) ALDH1A1BLMMEN1LMNACYP3A4
SCHEMBL20662562 0.69 MEN1 (0.58) ALDH1A1BLMMEN1LMNACYP3A4
SCHEMBL7801077 0.68 PNP (0.36) ALDH1A1PNP
SCHEMBL618978 0.67 PNP (0.44) ALDH1A1BLMMEN1LMNAKMT2A
SCHEMBL21539483 0.67 GDA (0.36) ALDH1A1BLMMEN1KMT2APNP
SCHEMBL24264290 0.67 TYMP (0.50) ALDH1A1BLMLMNAHSD17B10POLB
SCHEMBL18759052 0.67 HPRT1 (0.57) ALDH1A1BLMMEN1LMNACYP3A4

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-2024144320-A1 ANTIVIRAL COMPOSITION COMPRISING NUCLEOSIDE ANALOGUES DERIVED FROM NUCLEIC ACID AND PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF 씨제이제일제당 (주) 2024-07-04 — — WO disclosed
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