SCHEMBL9318294

SCHEMBL9318294

Cc1nc(CCn2cnc3c2c(=O)[nH]c(=O)n3C)no1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.56
MAPK1 P28482 2/20 0.55
KDM4E B2RXH2 1/20 0.55
LMNA P02545 1/20 0.55
POLB P06746 1/20 0.55
CYP3A4 P08684 1/20 0.50
PMP22 Q01453 1/20 0.50
PDE4A P27815 4/20 0.47
ADORA2A P29274 4/20 0.47
PDE4B Q07343 4/20 0.47
PDE4C Q08493 4/20 0.47
PDE4D Q08499 4/20 0.47
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
ALDH1A1 P00352 1/20 0.45
BRD4 O60885 2/20 0.42
BRD2 P25440 1/20 0.42
BRD3 Q15059 1/20 0.42
BRDT Q58F21 1/20 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
SCHEMBL9317709 0.93 MAPK1 (0.61) SMN1; SMN2MAPK1KDM4ELMNAPOLB
SCHEMBL9318299 0.92 MAPK1 (0.57) SMN1; SMN2MAPK1KDM4ELMNAPOLB
SCHEMBL9318253 0.91 SMN1; SMN2 (0.53) SMN1; SMN2MAPK1KDM4ELMNAPOLB
SCHEMBL9318323 0.82 SMN1; SMN2 (0.50) SMN1; SMN2MAPK1KDM4ELMNAPOLB
SCHEMBL9317749 0.82 SMN1; SMN2 (0.49) SMN1; SMN2MAPK1KDM4ELMNAPOLB
SCHEMBL10650189 0.81 ALDH1A1 (0.58) SMN1; SMN2MAPK1LMNAKMT2AALDH1A1
SCHEMBL9317979 0.80 SMN1; SMN2 (0.58) SMN1; SMN2MAPK1KDM4ELMNAPOLB
SCHEMBL9317968 0.80 SMN1; SMN2 (0.55) SMN1; SMN2MAPK1KDM4ELMNAPOLB
Hydrochloric Acid SCHEMBL9318684 0.79 SMN1; SMN2 (0.57) SMN1; SMN2MAPK1KDM4ELMNAPOLB
SCHEMBL9318279 0.77 SMN1; SMN2 (0.49) SMN1; SMN2MAPK1KDM4ELMNAPOLB

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 5 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
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