SCHEMBL8889330

SCHEMBL8889330

CC1(C)Oc2ccc(OCc3nc4cc(F)c(F)cc4s3)cc2C(=O)C1Cc1cccc(NS(=O)(=O)C(F)(F)F)c1

nearest known ligand 0.75

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYSLTR1 Q9Y271 11/20 0.58
CYSLTR2 Q9NS75 8/20 0.56

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
SCHEMBL8887563 0.87 CYSLTR1 (0.73) CYSLTR1CYSLTR2
SCHEMBL8889251 0.81 CYSLTR1 (0.38) CYSLTR1CYSLTR2
SCHEMBL8889592 0.81 CYSLTR1 (0.56) CYSLTR1CYSLTR2
SCHEMBL8889705 0.80 CYSLTR1 (0.56) CYSLTR1CYSLTR2
SCHEMBL8889712 0.80 CYSLTR1 (0.56) CYSLTR1CYSLTR2
SCHEMBL8888723 0.80 CYSLTR1 (0.64) CYSLTR1CYSLTR2
SCHEMBL8888727 0.80 CYSLTR1 (0.64) CYSLTR1CYSLTR2
SCHEMBL8888465 0.78 CYSLTR1 (0.64) CYSLTR1CYSLTR2
SCHEMBL8888459 0.78 CYSLTR1 (0.64) CYSLTR1CYSLTR2
SCHEMBL8888199 0.78 CYSLTR1 (0.64) CYSLTR1CYSLTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5641789-A INHIBITORS OF LEUKOTRIENES AND/OR BLOCKERS OF LEUKOTRIENE RECEPTORS; USEFUL IN PREVENTION OR TREATMENT OF ASTHMA, ARTHRITIS, PSORIASIS, ULCERS, MYOCARDIAL INFARCTION PFIZER INC. (US) 1997-06-24 US disclosed