SCHEMBL9645457

SCHEMBL9645457

CCCCCCCCc1ccc(N2CCCC(=O)N2)cc1

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 14/20 0.55
FAAH O00519 1/20 0.50
MGLL Q99685 1/20 0.50
S1PR1 P21453 2/20 0.45

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
SCHEMBL9644516 0.94 ALOX5 (0.57) ALOX5
SCHEMBL9644485 0.83 ALOX5 (0.74) ALOX5
SCHEMBL9647049 0.80 ALOX5 (0.56) ALOX5
SCHEMBL10515587 0.78 ALOX5 (0.54) ALOX5FAAHMGLL
SCHEMBL19144089 0.76 USP2 (0.54) FAAHMGLLS1PR1
SCHEMBL9645657 0.75 ALOX5 (0.80) ALOX5
SCHEMBL10512680 0.74 ALOX5 (0.73) ALOX5
SCHEMBL11015392 0.74 ALOX5 (0.55) ALOX5
SCHEMBL10878292 0.73 ALOX5 (0.67) ALOX5MGLL
SCHEMBL7200517 0.73 MGLL (0.65) FAAHMGLLS1PR1

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-5086052-A Antiarthritic, antiallergens, antiinflammatory agents; also for asthma and psoriasis ABBOTT LABORATORIES (US) 1992-02-04 US disclosed
US-4970210-A ENZYME INHIBITORS ABBOTT LABORATORIES (US) 1990-11-13 US disclosed
EP-0299449-A2 Pyridazinone, triazinone and oxapyridazinone lipoxygenase inhibiting compounds ABBOTT LABORATORIES (US) 1989-01-18 EP disclosed