SCHEMBL10970071

SCHEMBL10970071

COc1ccc(-c2c/c(=N/c3c(C)cc(C)cc3C)n(C)c(=O)n2CCCN(C)C)cc1OC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE4A P27815 5/20 0.47
▸ PDE4B Q07343 5/20 0.47
▸ PDE4C Q08493 5/20 0.47
▸ PDE4D Q08499 5/20 0.47
▸ TSHR P16473 3/20 0.47
▸ SMN1; SMN2 Q16637 3/20 0.47
▸ MAPT P10636 3/20 0.47
▸ CYP3A4 P08684 2/20 0.47
▸ MAPK1 P28482 2/20 0.47
▸ TDP1 Q9NUW8 2/20 0.47
▸ ABCC4 O15439 1/20 0.47
▸ ABCC5 O15440 1/20 0.47
▸ CYP2D6 P10635 1/20 0.47
▸ CYP2C9 P11712 1/20 0.47
▸ NFKB1 P19838 1/20 0.47
▸ CYP2C19 P33261 1/20 0.47
▸ THPO P40225 1/20 0.47
▸ HIF1A Q16665 1/20 0.47
▸ KMT2A Q03164 2/20 0.46
▸ MEN1 O00255 1/20 0.46

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
SCHEMBL10731581 1.00 PDE4A (0.47) PDE4APDE4BPDE4CPDE4DTSHR
SCHEMBL10566643 0.87 PDE4B (0.51) PDE4APDE4BPDE4CPDE4DTSHR
SCHEMBL10566644 0.87 PDE4B (0.51) PDE4APDE4BPDE4CPDE4DTSHR
SCHEMBL9834662 0.86 PDE4B (0.52) PDE4APDE4BPDE4CPDE4DTSHR
SCHEMBL9834667 0.86 PDE4B (0.52) PDE4APDE4BPDE4CPDE4DTSHR
Hydrochloric Acid SCHEMBL10569610 0.85 TDP1 (0.52) PDE4APDE4BPDE4CPDE4DTSHR
Hydrochloric Acid SCHEMBL10569609 0.85 TDP1 (0.52) PDE4APDE4BPDE4CPDE4DTSHR
SCHEMBL10567307 0.83 MAPT (0.48) PDE4APDE4BPDE4CPDE4DTSHR
SCHEMBL10567311 0.83 MAPT (0.48) PDE4APDE4BPDE4CPDE4DTSHR
SCHEMBL10725789 0.83 MAPT (0.48) PDE4APDE4BPDE4CPDE4DTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0166564-A2 Pyrimidone derivatives, preparation thereof and use thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-01-02 — — EP disclosed
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