SCHEMBL8537735

SCHEMBL8537735

Nc1nc(N)c2ncn([C@@H]3C[C@H](CO)[C@@H]3CO)c2n1

nearest known ligand 0.76

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
AHCY P23526 12/20 0.76
ADORA2B P29275 1/20 0.53
PDE4D Q08499 2/20 0.43
PNP P00491 1/20 0.43
LMNA P02545 1/20 0.43
TP53 P04637 1/20 0.43
HTT P42858 1/20 0.43
PDE3A Q14432 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
RXFP1 Q9HBX9 1/20 0.43
CDK1 P06493 1/20 0.43
CCNB1 P14635 1/20 0.43
CCNE1 P24864 1/20 0.43
CDK2 P24941 1/20 0.43
NR1I2 O75469 1/20 0.42
ALB P02768 1/20 0.42

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
SCHEMBL10448110 1.00 AHCY (0.76) AHCYADORA2BPDE4DPNPLMNA
SCHEMBL10448109 1.00 AHCY (0.76) AHCYADORA2BPDE4DPNPLMNA
SCHEMBL8537728 1.00 AHCY (0.76) AHCYADORA2BPDE4DPNPLMNA
SCHEMBL10380907 1.00 AHCY (0.76) AHCYADORA2BPDE4DPNPLMNA
SCHEMBL9311442 0.90 AHCY (0.83) AHCYADORA2BPDE4DPNPLMNA
SCHEMBL9308655 0.89 AHCY (0.67) AHCYADORA2BPDE4DPNPLMNA
SCHEMBL10380515 0.88 AHCY (0.59) AHCYADORA2BPDE4DPNPLMNA
SCHEMBL8537046 0.88 AHCY (0.59) AHCYADORA2BPDE4DPNPLMNA
SCHEMBL10448253 0.88 AHCY (0.59) AHCYADORA2BPDE4DPNPLMNA
SCHEMBL8872354 0.88 AHCY (0.59) AHCYADORA2BPDE4DNR1I2ALB

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-0358154-B1 Novel cyclobutane derivative and process for producing same NIPPON KAYAKU KK (JP) 1998-12-02 EP claimed
EP-0358154-B1 Novel cyclobutane derivative and process for producing same NIPPON KAYAKU KK (JP) 1998-12-02 EP disclosed
EP-0358154-A2 Novel cyclobutane derivative and process for producing same NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1990-03-14 EP disclosed