SCHEMBL7364378

SCHEMBL7364378

COc1c[c]ccc1-c1ccc(=O)[nH]n1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 5/20 0.51
PDE4A P27815 4/20 0.51
PDE4C Q08493 4/20 0.51
PDE4D Q08499 4/20 0.51
LMNA P02545 4/20 0.48
PDE3A Q14432 6/20 0.44
PDE3B Q13370 5/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
CYP1A2 P05177 2/20 0.44
TP53 P04637 1/20 0.44
CYP2C9 P11712 1/20 0.44
HPGD P15428 1/20 0.44
TSHR P16473 1/20 0.44
MAPK1 P28482 1/20 0.44
CYP2C19 P33261 1/20 0.44
BLM P54132 1/20 0.44
PMP22 Q01453 1/20 0.44
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
HRH3 Q9Y5N1 1/20 0.40

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
SCHEMBL7368982 0.77 CYP1A2 (0.42) PDE4BPDE4APDE4CPDE4DLMNA
SCHEMBL7366331 0.77 KMT2A (0.43) PDE4BPDE4APDE4CPDE4DLMNA
SCHEMBL8478264 0.75 LMNA (0.60) PDE4BPDE4APDE4CPDE4DLMNA
SCHEMBL6541679 0.73 CA1 (0.38) LMNATP53HPGDTSHRMAPK1
SCHEMBL8480289 0.72 LMNA (0.60) PDE4BPDE4APDE4CPDE4DLMNA
SCHEMBL3126336 0.69 PDE4B (0.49) PDE4BPDE4APDE4CPDE4DLMNA
SCHEMBL1917602 0.69 CYP1A2 (0.66) PDE4BPDE4APDE4CPDE4DLMNA
SCHEMBL8479743 0.68 PDE4A (1.00) PDE4BPDE4APDE4CPDE4DLMNA
SCHEMBL11005422 0.68 PDE4A (0.72) PDE4BPDE4APDE4CPDE4DLMNA
SCHEMBL2481127 0.68 NOTUM (0.45) NPC1RAB9AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1244669-A1 PYRAZOLOPYRAZINES AND THEIR USE AS ADENOSINE ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-10-02 EP disclosed
WO-2001040230-A1 PYRAZOLOPYRAZINES AND THEIR USE AS ADENOSINE ANTAGONISTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-06-07 WO disclosed