SCHEMBL8425280

SCHEMBL8425280

COc1cc(C(=O)O)ccc1Cc1c[nH]c2ccc(C(=O)OCc3ccccc3)cc12

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 2/20 0.56
IDO1 P14902 1/20 0.47
RXFP1 Q9HBX9 1/20 0.46
CYSLTR2 Q9NS75 1/20 0.46
CYSLTR1 Q9Y271 1/20 0.46
PLA2G4A P47712 4/20 0.45
HTR7 P34969 1/20 0.45
CPT1A P50416 1/20 0.44
CPT1B Q92523 1/20 0.44
SNCA P37840 2/20 0.43
TACR1 P25103 1/20 0.43
LNPEP Q9UIQ6 1/20 0.42
LTB4R Q15722 1/20 0.42
MEN1 O00255 1/20 0.42
HSP90AA1 P07900 1/20 0.42
HSP90AB1 P08238 1/20 0.42
LTA4H P09960 1/20 0.42
PLA2G2A P14555 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL8530246 0.94 GPR84 (0.65) GPR84IDO1RXFP1CYSLTR2CYSLTR1
SCHEMBL8427130 0.87 GPR84 (0.67) GPR84IDO1CYSLTR2CYSLTR1PLA2G4A
SCHEMBL8425282 0.86 GPR84 (0.58) GPR84IDO1RXFP1CYSLTR2CYSLTR1
SCHEMBL8427079 0.83 GPR84 (0.44) GPR84IDO1RXFP1CYSLTR2CYSLTR1
SCHEMBL8427078 0.82 GPR84 (0.46) GPR84CYSLTR2CYSLTR1SNCAMEN1
SCHEMBL8528458 0.82 GPR84 (0.73) GPR84IDO1CYSLTR2CYSLTR1HTR7
SCHEMBL8427419 0.80 PLA2G4A (0.56) GPR84IDO1CYSLTR2CYSLTR1PLA2G4A
SCHEMBL29251314 0.78 GPR84 (0.78) GPR84RXFP1MEN1KMT2A
SCHEMBL27273115 0.77 GPR84 (0.63) GPR84IDO1CYSLTR2CYSLTR1CPT1A
SCHEMBL6719869 0.77 PLA2G4A (0.58) GPR84IDO1CYSLTR2CYSLTR1PLA2G4A

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-0863873-B1 INDOLE CARBAMATES AS LEUKOTRIENE ANTAGONISTS PFIZER (US) 1999-11-10 EP disclosed
US-5965745-A ASTHMA; ANTIARTHRITIC,-SHOCK AGENTS; BRONCHITIS; RESPIRATORY SYSTEM DISEASES, E.G. CHRONIC OBSTRUCTIVE AIRWAYS DISEASES; PSORIASIS; ALLERGIC RHINITIS; ATOPIC DERMATITIS PFIZER INC (US) 1999-10-12 US disclosed
EP-0863873-A1 INDOLE CARBAMATES AS LEUKOTRIENE ANTAGONISTS PFIZER INC. (US) 1998-09-16 EP disclosed
WO-1997013751-A1 INDOLE CARBAMATES AS LEUKOTRIENE ANTAGONISTS PFIZER INC. (US) 1997-04-17 WO disclosed