SCHEMBL8782091

SCHEMBL8782091

O=C(O)C1=CCCC1CCO

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 2/20 0.32
CHRNA4 P43681 2/20 0.32
ALDH1A1 P00352 1/20 0.32
CHRNA7 P36544 1/20 0.32

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
SCHEMBL11540093 0.86 NPC1 (0.32)
SCHEMBL7232483 0.84 CHRNB2 (0.33) CHRNB2CHRNA4ALDH1A1CHRNA7
SCHEMBL7232489 0.84 CHRNB2 (0.33) CHRNB2CHRNA4ALDH1A1CHRNA7
SCHEMBL18487402 0.83 HCAR2 (0.39) CHRNB2CHRNA4ALDH1A1CHRNA7
SCHEMBL5611188 0.79 CHRNB2 (0.32) CHRNB2CHRNA4ALDH1A1CHRNA7
SCHEMBL1463307 0.78 CHRNB2 (0.36) CHRNB2CHRNA4ALDH1A1CHRNA7
SCHEMBL5344387 0.76 F2 (0.35)
SCHEMBL561703 0.74 FAAH (0.35) CHRNB2CHRNA4ALDH1A1CHRNA7
SCHEMBL5073326 0.74 ADRA2A (0.35) CHRNB2CHRNA4ALDH1A1CHRNA7
SCHEMBL170779 0.74 CHRNB2 (0.30) CHRNB2CHRNA4ALDH1A1CHRNA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0636160-B1 PLASTIC MATERIAL FOR PACKAGING BOREALIS AS (DK) 1997-12-29 EP disclosed
US-5663232-A SEALABLE, PEELABLE NON-ADHESIVE POLYMER WITH POLYOLEFINS AND HYDROXYACRYLATE OF GLYCOL OR POLYGLYCOL FOR PACKAGE FILMS BOREALIS HOLDING A/S (FI) 1997-09-02 US disclosed
EP-0636160-A1 PLASTIC MATERIAL FOR PACKAGING BOREALIS A/S (DK) 1995-02-01 EP disclosed
WO-1993021268-A1 PLASTIC MATERIAL FOR PACKAGING BOREALIS HOLDING A/S (DK) 1993-10-28 WO disclosed