SCHEMBL7811083

SCHEMBL7811083

Cc1nccn1-c1ccc(COc2cccc(C3(C#N)CCOCC3)c2)cc1

nearest known ligand 0.61

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 19/20 0.61
GRM5 P41594 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
SCHEMBL7807664 0.92 ALOX5 (0.52) ALOX5GRM5
SCHEMBL7802398 0.88 ALOX5 (0.48) ALOX5
SCHEMBL8696022 0.85 ALOX5 (0.77) ALOX5
SCHEMBL7815083 0.82 ALOX5 (0.78) ALOX5
SCHEMBL6571511 0.80 ALOX5 (0.68) ALOX5
SCHEMBL8783922 0.77 ALOX5 (0.80) ALOX5
SCHEMBL7811098 0.76 ALOX5 (0.68) ALOX5GRM5
SCHEMBL8787947 0.76 ALOX5 (1.00) ALOX5
SCHEMBL8783123 0.76 ALOX5 (1.00) ALOX5
Hydrochloric Acid SCHEMBL8783316 0.75 ALOX5 (0.98) ALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0787127-B1 5-LIPOXYGENASE INHIBITORS PFIZER (US) 2001-01-03 EP disclosed
US-6063928-A ANTIINFLAMMATORY AGENTS, ANTIALLERGENS, CARDIOTONIC AGENTS PFIZER INC (US) 2000-05-16 US disclosed