SCHEMBL8619444

SCHEMBL8619444

O=C(Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)C[C@H]1F)c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC29A1 Q99808 2/20 0.47
▸ ADORA1 P30542 6/20 0.47
▸ LMNA P02545 2/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ GLA P06280 1/20 0.46
▸ PMP22 Q01453 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ NPC1 O15118 1/20 0.46
▸ NPY1R P25929 1/20 0.46
▸ HTT P42858 1/20 0.46
▸ NPY2R P49146 1/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ RXFP1 Q9HBX9 1/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ TSHR P16473 1/20 0.46
▸ NFKB1 P19838 1/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ CYP2C19 P33261 1/20 0.46
▸ THPO P40225 1/20 0.46
▸ ADORA3 P0DMS8 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
SCHEMBL8619439 1.00 SLC29A1 (0.47) SLC29A1ADORA1LMNAALDH1A1GLA
SCHEMBL21357718 0.92 NT5E (0.44) ADORA1ADORA3ADORA2AADORA2B
SCHEMBL31160198 0.90 SLC29A1 (0.59) SLC29A1ADORA1LMNAALDH1A1GLA
SCHEMBL18496467 0.90 SLC29A1 (0.59) SLC29A1ADORA1LMNAALDH1A1GLA
SCHEMBL19146419 0.89 PRMT6 (0.44) ADORA1ADORA3ADORA2AADORA2B
SCHEMBL21539900 0.86 ADORA1 (0.46) SLC29A1ADORA1ADORA3ADORA2AADORA2B
SCHEMBL8618438 0.85 SLC29A1 (0.51) SLC29A1ADORA1ADORA3ADORA2AADORA2B
SCHEMBL8618443 0.85 SLC29A1 (0.51) SLC29A1ADORA1ADORA3ADORA2AADORA2B
SCHEMBL18496429 0.85 SLC29A1 (0.48) SLC29A1ADORA1LMNAALDH1A1GLA
SCHEMBL18496420 0.84 P2RY12 (0.45) SLC29A1ADORA1LMNAALDH1A1GLA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5817799-A 2'-Fluorofuranosyl derivatives and methods for preparing 2'-fluoropyrimidine and 2'-fluoropurine nucleosides THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1998-10-06 — — US disclosed
EP-0540686-B1 2'-FLUOROFURANOSYL DERIVATIVES AND NOVEL METHOD OF PREPARING 2'-FLUOROPYRIMIDINE AND 2'-FLUOROPURINE NUCLEOSIDES US COMMERCE (US) 1995-08-30 — — EP disclosed
US-5336764-A 2'-fluorofuranosyl derivatives and novel method of preparing 2'-fluoropyrimidine and 2'-fluoropurine nucleosides THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1994-08-09 — — US disclosed
Send feedback