SCHEMBL9215307

SCHEMBL9215307

Nc1ncnc2c1nc(Cl)n2C1C(Cl)=C(CO)C(O)C1O

nearest known ligand 0.66

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
AHCY P23526 8/20 0.66
HSPA8 P11142 3/20 0.44
HSPA5 P11021 2/20 0.44
PDE4A P27815 1/20 0.42
PDE4B Q07343 1/20 0.42
PDE4C Q08493 1/20 0.42
PDE4D Q08499 1/20 0.42
RXFP1 Q9HBX9 1/20 0.40
SLC28A2 O43868 1/20 0.39
HSD17B10 Q99714 1/20 0.39
GAPDH P04406 1/20 0.39

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
SCHEMBL9215301 1.00 AHCY (0.66) AHCYHSPA8HSPA5PDE4APDE4B
SCHEMBL9223113 0.88 AHCY (0.64) AHCYHSPA8HSPA5PDE4APDE4B
SCHEMBL9223106 0.88 AHCY (0.64) AHCYHSPA8HSPA5PDE4APDE4B
SCHEMBL9216846 0.80 AHCY (1.00) AHCYSLC28A2GAPDH
SCHEMBL9214858 0.80 AHCY (1.00) AHCYSLC28A2GAPDH
SCHEMBL9214869 0.80 AHCY (1.00) AHCYSLC28A2GAPDH
SCHEMBL9213150 0.75 AHCY (0.58) AHCYHSPA8HSPA5PDE4APDE4B
SCHEMBL864060 0.75 AHCY (0.58) AHCYHSPA8HSPA5PDE4APDE4B
SCHEMBL9217733 0.73 AHCY (0.60) AHCYHSPA8HSPA5PDE4APDE4B
SCHEMBL9217727 0.73 AHCY (0.60) AHCYHSPA8HSPA5PDE4APDE4B

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
EP-0347852-B1 Novel neplanocin derivatives MERRELL DOW PHARMA (US) 1995-08-23 EP claimed
EP-0347852-A2 Novel neplanocin derivatives MERRELL DOW PHARMACEUTICALS INC. (US) 1989-12-27 EP claimed
EP-0347852-B1 Novel neplanocin derivatives MERRELL DOW PHARMA (US) 1995-08-23 EP disclosed