SCHEMBL7792849

SCHEMBL7792849

c1ccc(COc2ccc(-c3nc4cccc(OCc5ccccc5)c4[nH]3)cc2C23CC4CC(CC(C4)C2)C3)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 1/20 0.40
PDE4B Q07343 1/20 0.40
PDE4C Q08493 1/20 0.40
PDE4D Q08499 1/20 0.40
TRPV6 Q9H1D0 1/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
ALOX5AP P20292 1/20 0.38
RARA P10276 2/20 0.37
RARB P10826 2/20 0.37
RARG P13631 2/20 0.37
FAAH O00519 1/20 0.37
CNR1 P21554 1/20 0.37
CNR2 P34972 1/20 0.37
PRMT5 O14744 8/20 0.37
HDAC11 Q96DB2 1/20 0.36
NR1I2 O75469 1/20 0.36
LMNA P02545 1/20 0.36
PGR P06401 1/20 0.36

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
SCHEMBL9278077 0.88 PDE4A (0.47) PDE4APDE4BPDE4CPDE4DMEN1
SCHEMBL7792844 0.85 DHODH (0.44) PDE4APDE4BPDE4CPDE4DTRPV6
SCHEMBL7793501 0.83 PRMT5 (0.46) PDE4APDE4BPDE4CPDE4DALOX5AP
SCHEMBL7793505 0.83 CHEK2 (0.49) PDE4APDE4BPDE4CPDE4DSMN1; SMN2
SCHEMBL7792898 0.81 PDE4A (0.53) PDE4APDE4BPDE4CPDE4DMEN1
SCHEMBL7792893 0.81 PDE4A (0.47) PDE4APDE4BPDE4CPDE4DMEN1
SCHEMBL7786900 0.77 PDE4A (0.53) PDE4APDE4BPDE4CPDE4DMEN1
SCHEMBL7786898 0.77 PDE4A (0.47) PDE4APDE4BPDE4CPDE4DMEN1
SCHEMBL7786844 0.76 CHEK2 (0.49) PDE4APDE4BPDE4CPDE4DSMN1; SMN2
SCHEMBL7786839 0.76 PRMT5 (0.44) PDE4APDE4BPDE4CPDE4DPRMT5

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-0643701-B1 BENZIMIDAZOLE-DERIVED COMPOUNDS, METHOD FOR PREPARING SAME, AND THERAPEUTICAL AND COSMETIC USES THEREOF CT INTERNAT DE RECH S BR DERMA (FR) 2001-12-05 EP disclosed
US-5446059-A Treating or preventing inflammatory or immunoallergic conditions CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (CIRD GALDERMA) (FR) 1995-08-29 US disclosed