SCHEMBL7986152

SCHEMBL7986152

CCCCCCOc1ccc(-c2nc3cc(C(=O)c4ccccc4)ccc3[nH]2)cc1OC

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 4/20 0.55
PDE4B Q07343 4/20 0.55
PDE4C Q08493 4/20 0.55
PDE4D Q08499 4/20 0.55
AMY1A P0DUB6 3/20 0.48
MPO P05164 1/20 0.47
HPSE Q9Y251 1/20 0.45
POLB P06746 1/20 0.44
HPGD P15428 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
GUSB P08236 1/20 0.44
CHEK2 O96017 1/20 0.44
LTB4R Q15722 1/20 0.43
CDK4 P11802 1/20 0.43
CCND1 P24385 1/20 0.43
THRA P10827 1/20 0.43
THRB P10828 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
MGAM O43451 1/20 0.43

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
SCHEMBL7996211 0.81 CYP1A1 (0.59) PDE4APDE4BPDE4CPDE4DPOLB
SCHEMBL7151164 0.81 PDE4A (0.77) PDE4APDE4BPDE4CPDE4DAMY1A
SCHEMBL8000047 0.79 PDE4A (0.43) PDE4APDE4BPDE4CPDE4DAMY1A
SCHEMBL15455891 0.79 PDE4A (0.65) PDE4APDE4BPDE4CPDE4DAMY1A
SCHEMBL7334119 0.76 RARB (0.62) CHEK2
SCHEMBL14382293 0.76 PDE4A (0.85) PDE4APDE4BPDE4CPDE4DAMY1A
SCHEMBL13790358 0.75 LTB4R (0.61) POLBHPGDL3MBTL1LTB4RTHRA
SCHEMBL7371345 0.74 PDE4A (0.67) PDE4APDE4BPDE4CPDE4DCHEK2
SCHEMBL3560621 0.74 KDM4E (0.66) HPGDCHEK2MEN1KMT2A
SCHEMBL34467256 0.74 CHEK2 (0.64) POLBHPGDCHEK2MEN1KMT2A

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-6288100-B1 SUCH AS PHENYL-(2-PROPYL-1H-BENZIMIDAZOL-5-YL)-METHANONE USEFUL AS INHIBITORS OF SMOOTH MUSCLE CELL PROLIFERATION AMERICAN HOME PRODUCTS CORPORATION 2001-09-11 US claimed
US-6288100-B1 SUCH AS PHENYL-(2-PROPYL-1H-BENZIMIDAZOL-5-YL)-METHANONE USEFUL AS INHIBITORS OF SMOOTH MUSCLE CELL PROLIFERATION AMERICAN HOME PRODUCTS CORPORATION 2001-09-11 US disclosed