SCHEMBL26316078

SCHEMBL26316078

Nc1nc2c(ncn2[C@H]2CC[C@@H](COP(O)OP(O)OP(O)O)O2)c(=O)[nH]1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.47
▸ LMNA P02545 1/20 0.47
▸ ALB P02768 1/20 0.47
▸ MAPK1 P28482 1/20 0.47
▸ POLB P06746 1/20 0.46
▸ PNP P00491 1/20 0.42
▸ HINT1 P49773 4/20 0.42
▸ NT5E P21589 1/20 0.42
▸ TGM2 P21980 1/20 0.41
▸ HPRT1 P00492 1/20 0.41
▸ ADORA3 P0DMS8 1/20 0.41
▸ GSK3A P49840 2/20 0.40
▸ RPS6KA3 P51812 2/20 0.40
▸ MAPK14 Q16539 2/20 0.40
▸ STING1 Q86WV6 1/20 0.40
▸ PDE3B Q13370 1/20 0.40
▸ PDE3A Q14432 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40

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
SCHEMBL26317106 1.00 ALDH1A1 (0.47) ALDH1A1LMNAALBMAPK1POLB
SCHEMBL26321543 1.00 ALDH1A1 (0.47) ALDH1A1LMNAALBMAPK1POLB
SCHEMBL24370792 0.86 POLB (0.49) ALDH1A1LMNAALBMAPK1POLB
SCHEMBL22351932 0.85 ALDH1A1 (0.48) ALDH1A1LMNAALBMAPK1POLB
SCHEMBL26196385 0.82 ALDH1A1 (0.55) ALDH1A1LMNAALBMAPK1POLB
SCHEMBL22523989 0.82 ALDH1A1 (0.52) ALDH1A1LMNAALBMAPK1POLB
SCHEMBL22402617 0.82 ALDH1A1 (0.52) ALDH1A1LMNAALBMAPK1POLB
SCHEMBL25057493 0.82 ALDH1A1 (0.52) ALDH1A1LMNAALBMAPK1POLB
SCHEMBL18520392 0.82 ALDH1A1 (0.52) ALDH1A1LMNAALBMAPK1POLB
SCHEMBL18763358 0.82 ALDH1A1 (0.52) ALDH1A1LMNAALBMAPK1POLB

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-4234566-A1 MODIFIED NUCLEOSIDE OR NUCLEOTIDE BGI Shenzhen (CN) 2023-08-30 — — EP disclosed
Send feedback