SCHEMBL7445176

SCHEMBL7445176

O=Cc1cc(-c2ccc(F)c(Cl)c2)c2ncccc2c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 1/20 0.41
CCR8 P51685 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
KMO O15229 1/20 0.39
TOP1 P11387 1/20 0.38
PTGS2 P35354 4/20 0.38
PTGS1 P23219 2/20 0.38
EPHB4 P54760 2/20 0.38
ALDH1A1 P00352 1/20 0.38
CYP11B2 P19099 1/20 0.37
SUCNR1 Q9BXA5 2/20 0.37
SLC40A1 Q9NP59 2/20 0.37
PDE4A P27815 1/20 0.36
PDE4B Q07343 1/20 0.36
PDE4C Q08493 1/20 0.36
PDE4D Q08499 1/20 0.36
GRM4 Q14833 1/20 0.36
PARP1 P09874 1/20 0.36
ADORA2A P29274 1/20 0.36
PTPN6 P29350 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
SCHEMBL7445247 0.88 CCR1 (0.44) CCR1CCR8L3MBTL1ALDH1A1PDE4A
SCHEMBL7437773 0.85 CCR1 (0.43) CCR1CCR8L3MBTL1TOP1ALDH1A1
SCHEMBL7437363 0.83 PDE4A (0.48) CCR1CCR8L3MBTL1SLC40A1PDE4A
SCHEMBL7438319 0.81 CCR1 (0.47) CCR1CCR8L3MBTL1KMOTOP1
SCHEMBL7446125 0.78 TOP1 (0.50) CCR1CCR8L3MBTL1TOP1PDE4A
SCHEMBL7442202 0.78 PDE4A (0.49) CCR1CCR8L3MBTL1TOP1EPHB4
SCHEMBL7434938 0.78 PDE4A (0.56) CCR1CCR8L3MBTL1TOP1PTGS2
SCHEMBL7436085 0.77 PDE4A (0.59) CCR1CCR8L3MBTL1EPHB4CYP11B2
SCHEMBL1225086 0.76 CCR1 (0.50) CCR1CCR8L3MBTL1ALDH1A1SLC40A1
SCHEMBL1225281 0.76 TRPM5 (0.46) CCR1CCR8L3MBTL1ALDH1A1SLC40A1

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