SCHEMBL8465612

SCHEMBL8465612

O[C@H]1c2cc(OCc3ccc4ccccc4n3)ccc2OC[C@@H]1Oc1ccccc1

nearest known ligand 0.63

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 4/20 0.63
CYSLTR1 Q9Y271 8/20 0.53
CYSLTR2 Q9NS75 5/20 0.53
PDE10A Q9Y233 1/20 0.50
GPBAR1 Q8TDU6 4/20 0.49

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
SCHEMBL8465168 1.00 LTB4R (0.63) LTB4RCYSLTR1CYSLTR2PDE10AGPBAR1
SCHEMBL8466100 1.00 LTB4R (0.63) LTB4RCYSLTR1CYSLTR2PDE10AGPBAR1
SCHEMBL8466099 1.00 LTB4R (0.63) LTB4RCYSLTR1CYSLTR2PDE10AGPBAR1
SCHEMBL8464738 0.93 LTB4R (0.60) LTB4RCYSLTR1CYSLTR2PDE10AGPBAR1
SCHEMBL8464747 0.93 LTB4R (0.60) LTB4RCYSLTR1CYSLTR2PDE10AGPBAR1
SCHEMBL8464750 0.93 LTB4R (0.60) LTB4RCYSLTR1CYSLTR2PDE10AGPBAR1
SCHEMBL8463992 0.91 LTB4R (0.59) LTB4RCYSLTR1CYSLTR2PDE10AGPBAR1
SCHEMBL8462779 0.91 LTB4R (0.59) LTB4RCYSLTR1CYSLTR2PDE10AGPBAR1
SCHEMBL8465459 0.91 LTB4R (0.72) LTB4RCYSLTR1CYSLTR2PDE10AGPBAR1
SCHEMBL8522473 0.91 LTB4R (0.72) LTB4RCYSLTR1CYSLTR2PDE10AGPBAR1

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
US-5998451-A LIPOXYGENASE INHIBITORS PFIZER INC (US) 1999-12-07 US disclosed
US-5059609-A Lipoxygenase inhibitors; leukotriene receptor blockers; psoriasis; antiulcer agents and myocardial infarctions PFIZER INC. (US) 1991-10-22 US disclosed
EP-0313295-A2 Substituted tetralins, chromans and related compounds in the treatment of asthma, arthritis and related diseases PFIZER INC. (US) 1989-04-26 EP disclosed