SCHEMBL9318253

SCHEMBL9318253

Cc1nc(Cn2cnc3c2c(=O)[nH]c(=O)n3C)no1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.53
MAPK1 P28482 2/20 0.50
CYP3A4 P08684 1/20 0.50
PMP22 Q01453 1/20 0.50
KDM4E B2RXH2 1/20 0.49
LMNA P02545 1/20 0.49
POLB P06746 1/20 0.49
PDE4A P27815 3/20 0.44
ADORA2A P29274 3/20 0.44
PDE4B Q07343 3/20 0.44
PDE4C Q08493 3/20 0.44
PDE4D Q08499 3/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
ALDH1A1 P00352 1/20 0.43
BRD4 O60885 4/20 0.42
BRD2 P25440 2/20 0.42
BRD3 Q15059 2/20 0.42
BRDT Q58F21 2/20 0.42
TSHR P16473 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
SCHEMBL9318294 0.91 SMN1; SMN2 (0.56) SMN1; SMN2MAPK1CYP3A4PMP22KDM4E
SCHEMBL9317709 0.88 MAPK1 (0.61) SMN1; SMN2MAPK1CYP3A4PMP22KDM4E
SCHEMBL9318299 0.87 MAPK1 (0.57) SMN1; SMN2MAPK1CYP3A4PMP22KDM4E
SCHEMBL10691699 0.86 SMN1; SMN2 (0.51) SMN1; SMN2MAPK1CYP3A4PMP22KDM4E
SCHEMBL9318082 0.85 SMN1; SMN2 (0.50) SMN1; SMN2MAPK1CYP3A4PMP22KDM4E
SCHEMBL9318279 0.84 SMN1; SMN2 (0.49) SMN1; SMN2MAPK1CYP3A4PMP22KDM4E
SCHEMBL9317880 0.83 SMN1; SMN2 (0.48) SMN1; SMN2MAPK1CYP3A4PMP22KDM4E
SCHEMBL9318321 0.82 SMN1; SMN2 (0.47) SMN1; SMN2MAPK1CYP3A4PMP22KDM4E
SCHEMBL9318183 0.82 MAPK1 (0.49) SMN1; SMN2MAPK1CYP3A4PMP22KDM4E
SCHEMBL9317721 0.82 MAPK1 (0.54) SMN1; SMN2MAPK1CYP3A4PMP22KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0264081-B1 Oxadiazolyl alkyl purin derivatives, their preparation and their use in pharmaceutical compositions CHINOIN GYOGYSZER ES VEGYESZET (HU) 1994-01-05 EP claimed
US-4840949-A Oxadiazole-alkyl-purine derivatives useful as antitussive agents CHINOIN GYOGYSZER ES VEGYESZETI TERMEKEK GYARA RT. (HU) 1989-06-20 US claimed
EP-0264081-A2 Oxadiazolyl alkyl purin derivatives, their preparation and their use in pharmaceutical compositions CHINOIN Gyogyszer és Vegyészeti Termékek Gyára RT. (HU) 1988-04-20 EP claimed
EP-0264081-B1 Oxadiazolyl alkyl purin derivatives, their preparation and their use in pharmaceutical compositions CHINOIN GYOGYSZER ES VEGYESZET (HU) 1994-01-05 EP disclosed
US-4840949-A Oxadiazole-alkyl-purine derivatives useful as antitussive agents CHINOIN GYOGYSZER ES VEGYESZETI TERMEKEK GYARA RT. (HU) 1989-06-20 US disclosed
EP-0264081-A2 Oxadiazolyl alkyl purin derivatives, their preparation and their use in pharmaceutical compositions CHINOIN Gyogyszer és Vegyészeti Termékek Gyára RT. (HU) 1988-04-20 EP disclosed