SCHEMBL7532983

SCHEMBL7532983

CCC1(c2cccc(O)c2)CCOCC1

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ACHE P22303 3/20 0.55
SLC22A1 O15245 1/20 0.55
CHRM2 P08172 1/20 0.55
SLC6A4 P31645 1/20 0.55
OPRM1 P35372 1/20 0.55
CYP2D6 P10635 1/20 0.55
ALOX5 P09917 1/20 0.45
OPRD1 P41143 1/20 0.43

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
SCHEMBL9136443 0.85 ALOX5 (0.45) ACHESLC22A1CHRM2SLC6A4OPRM1
SCHEMBL3271844 0.83 SLC6A4 (0.50) ACHESLC22A1CHRM2SLC6A4OPRM1
SCHEMBL23333048 0.81 ACHE (0.55) ACHESLC22A1CHRM2SLC6A4OPRM1
SCHEMBL14513169 0.79 ALDH1A1 (0.50) SLC6A4CYP2D6
SCHEMBL9250652 0.78 OPRM1 (0.44) ACHESLC22A1CHRM2SLC6A4OPRM1
SCHEMBL9138011 0.78 OPRD1 (0.63) OPRM1ALOX5OPRD1
SCHEMBL9219871 0.76 OPRD1 (0.44) SLC6A4OPRM1ALOX5OPRD1
SCHEMBL19145625 0.76 ACHE (0.77) ACHESLC22A1CHRM2SLC6A4OPRM1
SCHEMBL1599480 0.74 ALOX5 (0.54) ALOX5OPRD1
SCHEMBL9136365 0.73 OPRD1 (0.42) ACHESLC22A1CHRM2SLC6A4OPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1250332-A1 INHIBITORS OF INTERLEUKIN 5 GENE EXPRESSION Abbott Laboratories (US) 2002-10-23 EP disclosed
WO-2001044223-A1 INHIBITORS OF INTERLEUKIN 5 GENE EXPRESSION ABBOTT LABORATORIES (US) 2001-06-21 WO disclosed
EP-0462830-B1 Cyclic ether derivatives ZENECA LTD (GB) 1995-10-18 EP disclosed
US-5407945-A Pyran derivatives and their use as inhibitors of 5-lipoxygenase IMPERIAL CHEMICAL INDUSTRIES, INC. (GB) 1995-04-18 US disclosed
US-5254581-A Used in the treatment of various inflammatory and allergic diseases IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-10-19 US disclosed
EP-0462830-A2 Cyclic ether derivatives ZENECA LIMITED (GB) 1991-12-27 EP disclosed