SCHEMBL7635298

SCHEMBL7635298

Oc1nc(S)c2cn[nH]c2n1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
XDH P47989 4/20 0.34
RET P07949 1/20 0.34
PI4KA P42356 1/20 0.34
LRRK2 Q5S007 1/20 0.34
PI4K2B Q8TCG2 1/20 0.34
PI4K2A Q9BTU6 1/20 0.34
PI4KB Q9UBF8 1/20 0.34
GRK2 P25098 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
ALDH1A1 P00352 2/20 0.33
ADORA2A P29274 2/20 0.32
LMNA P02545 1/20 0.32
TSHR P16473 1/20 0.32
SLC6A4 P31645 1/20 0.32
ADRA1A P35348 1/20 0.32
RAB9A P51151 1/20 0.32
BLM P54132 1/20 0.32
PDPK1 O15530 1/20 0.32
CDK2 P24941 1/20 0.31
HTT P42858 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
Oxypurinol SCHEMBL49280 0.79 SMN1; SMN2 (0.38) XDHRETPI4KALRRK2PI4K2B
SCHEMBL6272754 0.79 XDH (0.36) XDHRETPI4KALRRK2PI4K2B
Oxypurinol SCHEMBL8905886 0.78 SMN1; SMN2 (0.37) XDHRETPI4KALRRK2PI4K2B
Oxypurinol SCHEMBL8905835 0.78 SMN1; SMN2 (0.37) XDHRETPI4KALRRK2PI4K2B
Oxypurinol SCHEMBL5799552 0.78 SMN1; SMN2 (0.37) XDHRETPI4KALRRK2PI4K2B
Oxypurinol SCHEMBL8905476 0.78 SMN1; SMN2 (0.37) XDHRETPI4KALRRK2PI4K2B
SCHEMBL13829698 0.76 HTR2C (0.40) XDHRETPI4KALRRK2PI4K2B
SCHEMBL7639054 0.76 XDH (0.34) XDHRETPI4KALRRK2PI4K2B
SCHEMBL2629520 0.76 ADORA2A (0.47) XDHRETPI4KALRRK2PI4K2B
SCHEMBL95394 0.76 XDH (0.52) XDHRETPI4KALRRK2PI4K2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0881875-A4 COMPOSITIONS AND METHODS FOR CONTROLLING PEST INSECTS VIRGINIA TECH INTELL PROP (US) 2002-03-06 EP claimed
US-6037344-A COMPRISING A PURINE SELECTED FROM THE GROUP CONSISTING OF XANTHINE, HYPOXANTHINE, GUANINE AND MIXTURES THEREOF, AND A XANTHINE OXIDASE INHIBITOR SELECTED FROM THE GROUP CONSISTING OF ALLOPURINOL, OXYPURINOL, MERCAPTO-ALLOPURINOL, VIRGINIA TECH INTELLECTUAL PROPERTIES, INC. (US) 2000-03-14 US claimed
EP-0881875-A1 COMPOSITIONS AND METHODS FOR CONTROLLING PEST INSECTS VIRGINIA TECH INTELLECTUAL PROPERTIES, INC. (US) 1998-12-09 EP claimed
WO-1997028686-A1 COMPOSITIONS AND METHODS FOR CONTROLLING PEST INSECTS VIRGINIA TECH INTELLECTUAL PROPERTIES, INC. (US) 1997-08-14 WO claimed
US-9775841-B2 Compounds as modulators of protein kinases RHIZEN PHARMACEUTICALS SA (CH) 2017-10-03 US disclosed
EP-0881875-A4 COMPOSITIONS AND METHODS FOR CONTROLLING PEST INSECTS VIRGINIA TECH INTELL PROP (US) 2002-03-06 EP disclosed
US-6037344-A COMPRISING A PURINE SELECTED FROM THE GROUP CONSISTING OF XANTHINE, HYPOXANTHINE, GUANINE AND MIXTURES THEREOF, AND A XANTHINE OXIDASE INHIBITOR SELECTED FROM THE GROUP CONSISTING OF ALLOPURINOL, OXYPURINOL, MERCAPTO-ALLOPURINOL, VIRGINIA TECH INTELLECTUAL PROPERTIES, INC. (US) 2000-03-14 US disclosed
US-5990115-A Compositions and methods for controlling pest insects VIRGINIA TECH INTELLECTUAL PROPERTIES, INC. (US) 1999-11-23 US disclosed
EP-0777417-A4 COMPOSITIONS AND METHODS FOR CONTROLLING PEST INSECTS VIRGINIA TECH INTELL PROP (US) 1999-03-17 EP disclosed
EP-0881875-A1 COMPOSITIONS AND METHODS FOR CONTROLLING PEST INSECTS VIRGINIA TECH INTELLECTUAL PROPERTIES, INC. (US) 1998-12-09 EP disclosed
WO-1997028686-A1 COMPOSITIONS AND METHODS FOR CONTROLLING PEST INSECTS VIRGINIA TECH INTELLECTUAL PROPERTIES, INC. (US) 1997-08-14 WO disclosed
EP-0777417-A1 COMPOSITIONS AND METHODS FOR CONTROLLING PEST INSECTS VIRGINIA TECH INTELLECTUAL PROPERTIES, INC. (US) 1997-06-11 EP disclosed
US-5620982-A MIXTURE OF A PURINE, OXYPURINOL, AND TRIMETHOPRIM; METABOLIC DISRUPTION, ANTIGROWTH AGENTS VIRGINIA TECH INTELLECTUAL PROPERTIES (US) 1997-04-15 US disclosed
WO-1996004791-A1 COMPOSITIONS AND METHODS FOR CONTROLLING PEST INSECTS VIRGINIA TECH INTELLECTUAL PROPERTIES, INC. (US) 1996-02-22 WO disclosed