SCHEMBL7444308

SCHEMBL7444308

CCc1ccc(C(=O)c2[nH]c(=O)[nH]c2CC)nc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 2/20 0.55
PDE3A Q14432 2/20 0.55
PDE4A P27815 14/20 0.48
PDE4B Q07343 14/20 0.48
PDE4C Q08493 14/20 0.48
PDE4D Q08499 14/20 0.48
MPC2 O95563 1/20 0.41
CYP2C8 P10632 1/20 0.41
CYP2C9 P11712 1/20 0.41
PPARG P37231 1/20 0.41
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
MAPT P10636 1/20 0.38
PKM P14618 1/20 0.38
ALOX15 P16050 1/20 0.38
TSHR P16473 1/20 0.38

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
SCHEMBL7440527 0.89 NFKB1 (0.56) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL9787386 0.86 PDE3B (0.39) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10638996 0.84 PDE3B (0.56) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10632498 0.82 PDE3B (0.50) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10639116 0.81 PDE3B (0.52) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10638881 0.80 PDE3B (0.48) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7440629 0.79 PDE3B (0.59) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7434015 0.73 PDE3B (0.56) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL10639159 0.71 PDE3B (0.54) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL7438562 0.71 PDE3B (0.53) PDE3BPDE3APDE4APDE4BPDE4C

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
US-4405628-A 4-Pyridylimidazolones and method of use MERRELL DOW PHARMACEUTICALS INC. (US) 1983-09-20 US disclosed
EP-0059948-A1 Novel aroylimidazolones MERRELL DOW PHARMACEUTICALS INC. (US) 1982-09-15 EP disclosed