SCHEMBL7440477

SCHEMBL7440477

CCCCCc1cc(-c2ccc(Cl)c(Cl)c2)c2ncccc2c1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 14/20 0.45
PDE4B Q07343 12/20 0.45
PDE4C Q08493 11/20 0.45
PDE4D Q08499 11/20 0.45
TRPV1 Q8NER1 1/20 0.42
HSD11B1 P28845 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
CCR1 P32246 1/20 0.40
CCR8 P51685 1/20 0.40
TDP1 Q9NUW8 1/20 0.37
HRH1 P35367 1/20 0.37
KCNH2 Q12809 1/20 0.37
DHFR P00374 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
SCHEMBL7434171 0.86 PDE4A (0.49) PDE4APDE4BPDE4CPDE4DL3MBTL1
SCHEMBL7438491 0.86 PDE4A (0.57) PDE4APDE4BPDE4CPDE4DTRPV1
SCHEMBL7439316 0.84 PDE4A (0.54) PDE4APDE4BPDE4CPDE4DTRPV1
SCHEMBL7445586 0.83 PDE4A (0.53) PDE4APDE4BPDE4CPDE4DTRPV1
SCHEMBL7443375 0.82 PDE4A (0.58) PDE4APDE4BPDE4CPDE4DTRPV1
SCHEMBL7444931 0.79 PDE4A (0.52) PDE4APDE4BPDE4CPDE4DL3MBTL1
SCHEMBL7437244 0.77 CCR1 (0.50) PDE4APDE4BPDE4CPDE4DL3MBTL1
SCHEMBL7448938 0.77 PDE4A (0.60) PDE4APDE4BPDE4CPDE4DDHFR
SCHEMBL7440932 0.77 PDE4A (0.67) PDE4APDE4BPDE4CPDE4DTRPV1
SCHEMBL7446525 0.76 PDE4A (0.66) PDE4APDE4BPDE4CPDE4DTRPV1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0691966-B1 QUINOLINES AS TYPE IV PHOSPHODIESTERASE INHIBITORS SYNTEX INC (US) 1998-09-09 EP disclosed
EP-0691966-A1 QUINOLINES AS TYPE IV PHOSPHODIESTERASE INHIBITORS SYNTEX (U.S.A.) INC. (US) 1996-01-17 EP disclosed
US-5455252-A Antiinflammatory agent, immunosuppressant, antiallergen, skin disorders, bronchodilator, analgesic SYNTEX (U.S.A.) INC. (US) 1995-10-03 US disclosed
WO-1994022852-A1 QUINOLINES AS TYPE IV PHOSPHODIESTERASE INHIBITORS SYNTEX (U.S.A.) INC. (US) 1994-10-13 WO disclosed