SCHEMBL9366246

SCHEMBL9366246

CCC1(c2ccc(OCc3ccc4ccccc4c3)c(OC)c2)COC(C)(C)O1

nearest known ligand 0.53

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 16/20 0.53
GSK3B P49841 1/20 0.38
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37

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
SCHEMBL9366361 0.83 ALOX5 (0.74) ALOX5
SCHEMBL9368934 0.74 ALOX5 (0.64) ALOX5
SCHEMBL9219450 0.74 ALOX5 (0.76) ALOX5
SCHEMBL9583811 0.73 ALOX5 (0.66) ALOX5
SCHEMBL9217915 0.73 ALOX5 (0.61) ALOX5
SCHEMBL9365123 0.73 ALOX5 (0.51) ALOX5
SCHEMBL9022908 0.72 ALOX5 (0.57) ALOX5
SCHEMBL9364733 0.72 ALOX5 (0.60) ALOX5
SCHEMBL9364895 0.72 ALOX5 (0.57) ALOX5
SCHEMBL9370663 0.72 ALOX5 (0.66) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0419327-B1 Amino acid derivatives, method for their preparation and their therapeutic application BIOPROJET SOC CIV (FR) 1994-07-27 EP disclosed
EP-0375457-B1 Cyclic ether derivatives ICI PLC (GB) 1994-03-16 EP disclosed
US-5219881-A Enzyme inhibitors IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-06-15 US disclosed
US-5098932-A Inhibitors of lipoxygenase for treatment of diseases mediated with leukotrienes IMPERIAL CHEMICAL INDUSTRIES PLC, ICI PHARMA (FR) 1992-03-24 US disclosed
EP-0375457-A2 Cyclic ether derivatives IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-06-27 EP disclosed