SCHEMBL10690965

SCHEMBL10690965

Clc1ccc(OCc2ccc3ccccc3n2)cc1

nearest known ligand 0.76

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYSLTR1 Q9Y271 9/20 0.76
CYSLTR2 Q9NS75 5/20 0.76
PDE10A Q9Y233 3/20 0.67
GPBAR1 Q8TDU6 5/20 0.65
ALOX5AP P20292 2/20 0.65
ALOX5 P09917 2/20 0.60
FFAR1 O14842 1/20 0.59
AKR1B1 P15121 1/20 0.59

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
SCHEMBL8645017 0.90 CYSLTR1 (0.70) CYSLTR1CYSLTR2PDE10AGPBAR1ALOX5AP
SCHEMBL10547998 0.86 CYSLTR1 (1.00) CYSLTR1CYSLTR2PDE10AGPBAR1FFAR1
SCHEMBL10549569 0.86 CYSLTR1 (0.69) CYSLTR1CYSLTR2PDE10AGPBAR1ALOX5AP
SCHEMBL6583310 0.85 CYSLTR1 (0.78) CYSLTR1CYSLTR2PDE10AGPBAR1ALOX5AP
SCHEMBL5160956 0.84 CYSLTR1 (0.74) CYSLTR1CYSLTR2PDE10AGPBAR1ALOX5
SCHEMBL9189491 0.84 CYSLTR1 (0.57) CYSLTR1CYSLTR2PDE10AGPBAR1ALOX5AP
SCHEMBL9469819 0.84 CYSLTR1 (0.57) CYSLTR1CYSLTR2PDE10AGPBAR1ALOX5AP
SCHEMBL4159309 0.84 CYSLTR1 (0.76) CYSLTR1CYSLTR2PDE10AGPBAR1ALOX5
SCHEMBL10547699 0.84 CYSLTR1 (0.76) CYSLTR1CYSLTR2PDE10AGPBAR1ALOX5
SCHEMBL7715797 0.84 CYSLTR1 (0.76) CYSLTR1CYSLTR2PDE10AGPBAR1ALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0223368-A1 Substituted naphthalene derivatives AMERICAN HOME PRODUCTS CORPORATION (US) 1987-05-27 EP claimed
US-4732978-A RESPIRATORY SYSTEM DISORDERS AMERICAN HOME PRODUCTS CORPORATION (US) 1988-03-22 US disclosed
EP-0223368-A1 Substituted naphthalene derivatives AMERICAN HOME PRODUCTS CORPORATION (US) 1987-05-27 EP disclosed