SCHEMBL7437244

SCHEMBL7437244

Cc1cc(-c2ccc(Cl)c(Cl)c2)c2ncccc2c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 4/20 0.50
CCR8 P51685 4/20 0.50
CCR5 P51681 2/20 0.50
PSMD14 O00487 1/20 0.50
COPS5 Q92905 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.47
DHFR P00374 1/20 0.43
ALDH1A1 P00352 2/20 0.43
ADORA1 P30542 1/20 0.42
PDE4A P27815 2/20 0.41
PDE4B Q07343 2/20 0.41
PDE4C Q08493 2/20 0.41
PDE4D Q08499 2/20 0.41
CYP2C9 P11712 3/20 0.40
GLO1 Q04760 1/20 0.40
MDM2 Q00987 1/20 0.40
AHR P35869 1/20 0.40
ADORA2A P29274 1/20 0.39
SLC40A1 Q9NP59 1/20 0.39
KDM4E B2RXH2 1/20 0.39

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
SCHEMBL7438319 0.87 CCR1 (0.47) CCR1CCR8CCR5PSMD14COPS5
SCHEMBL7437210 0.85 CCR1 (0.53) CCR1CCR8CCR5PSMD14COPS5
SCHEMBL7440046 0.82 PDE4A (0.54) CCR1CCR8CCR5PSMD14COPS5
SCHEMBL7435290 0.82 PDE4A (0.56) CCR1CCR8L3MBTL1DHFRALDH1A1
SCHEMBL7434171 0.82 PDE4A (0.49) CCR1CCR8L3MBTL1DHFRALDH1A1
SCHEMBL7440672 0.80 CCR1 (0.57) CCR1CCR8CCR5PSMD14COPS5
SCHEMBL7445247 0.79 CCR1 (0.44) CCR1CCR8CCR5L3MBTL1DHFR
SCHEMBL31135866 0.77 PSMD14 (0.62) CCR1CCR8CCR5PSMD14COPS5
SCHEMBL11087820 0.77 PSMD14 (0.62) CCR1CCR8CCR5PSMD14COPS5
SCHEMBL7444931 0.77 PDE4A (0.52) CCR1CCR8L3MBTL1DHFRALDH1A1

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