SCHEMBL8317460

SCHEMBL8317460

[O]Cc1ccc(OCc2ccc3ccccc3n2)cc1

nearest known ligand 0.74

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYSLTR1 Q9Y271 9/20 0.74
CYSLTR2 Q9NS75 7/20 0.71
FFAR1 O14842 1/20 0.67
AKR1B1 P15121 1/20 0.67
GPBAR1 Q8TDU6 2/20 0.66
ALOX5 P09917 2/20 0.64
PDE10A Q9Y233 3/20 0.61

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
SCHEMBL10544473 0.86 CYSLTR1 (0.84) CYSLTR1CYSLTR2FFAR1AKR1B1GPBAR1
SCHEMBL12188824 0.85 CYSLTR1 (0.70) CYSLTR1CYSLTR2FFAR1AKR1B1GPBAR1
SCHEMBL5160956 0.85 CYSLTR1 (0.74) CYSLTR1CYSLTR2FFAR1AKR1B1GPBAR1
SCHEMBL3076102 0.85 CYSLTR1 (1.00) CYSLTR1CYSLTR2FFAR1AKR1B1GPBAR1
SCHEMBL8001866 0.85 CYSLTR1 (0.74) CYSLTR1CYSLTR2FFAR1AKR1B1GPBAR1
SCHEMBL4159309 0.84 CYSLTR1 (0.76) CYSLTR1CYSLTR2FFAR1AKR1B1GPBAR1
SCHEMBL8321128 0.84 CYSLTR1 (0.76) CYSLTR1CYSLTR2GPBAR1ALOX5PDE10A
SCHEMBL10547998 0.84 CYSLTR1 (1.00) CYSLTR1CYSLTR2FFAR1AKR1B1GPBAR1
Hydrochloric Acid SCHEMBL7009696 0.84 CYSLTR1 (0.72) CYSLTR1CYSLTR2FFAR1AKR1B1GPBAR1
SCHEMBL1419872 0.83 FFAR1 (0.77) CYSLTR1CYSLTR2FFAR1AKR1B1GPBAR1

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-0920425-A1 SUBSTITUTED 4-(1H-BENZIMIDAZOL-2-YL-AMINO)PIPERIDINES USEFUL FOR THE TREATMENT OF ALLERGIC DISEASES HOECHST MARION ROUSSEL, INC. (US) 1999-06-09 EP disclosed
US-5885987-A ANTIHISTAMINE AGENT FOR TREATING ASTHMA, ANTILEUKOTRIENE AGENT, ANTIALLERGENS KOWA CO., LTD. (JP) 1999-03-23 US disclosed
US-5756518-A EXHIBITS ANTILEUKOTRIENIC ACTION AND ANTIHISTAMINIC ACTION; IS USEFUL IN TREATMENT OF ASTHMA KOWA CO., LTD. (JP) 1998-05-26 US disclosed
WO-1997019074-A1 SUBSTITUTED 4-(1H-BENZIMIDAZOL-2-YL-AMINO)PIPERIDINES USEFUL FOR THE TREATMENT OF ALLERGIC DISEASES HOECHST MARION ROUSSEL, INC. (US) 1997-05-29 WO disclosed