SCHEMBL7604221

SCHEMBL7604221

O=C(OCC1CCCC(COC(=O)c2ccccc2)C1)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 2/20 0.55
CHRNA4 P43681 2/20 0.55
CHRNA5 P30532 1/20 0.55
CHRNA7 P36544 1/20 0.55
CARM1 Q86X55 1/20 0.52
PRMT6 Q96LA8 1/20 0.52
KMT2A Q03164 2/20 0.50
MEN1 O00255 1/20 0.50
ATM Q13315 1/20 0.50
DRD2 P14416 1/20 0.49
DRD4 P21917 1/20 0.49
TDP1 Q9NUW8 2/20 0.49
CHRM2 P08172 1/20 0.48
CHRM4 P08173 1/20 0.48
CHRM1 P11229 1/20 0.48
CHRM3 P20309 1/20 0.48
MAPK1 P28482 1/20 0.47
HIF1A Q16665 1/20 0.47
SLC6A2 P23975 1/20 0.47
SLC6A3 Q01959 1/20 0.47

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
SCHEMBL25445958 0.93 CARM1 (0.58) CHRNB2CHRNA4CHRNA5CHRNA7CARM1
SCHEMBL22005207 0.90 CARM1 (0.58) CHRNB2CHRNA4CHRNA5CHRNA7CARM1
SCHEMBL9005573 0.88 CARM1 (0.57) CHRNB2CHRNA4CHRNA5CHRNA7CARM1
SCHEMBL7452740 0.88 CARM1 (0.57) CHRNB2CHRNA4CHRNA5CHRNA7CARM1
SCHEMBL8447322 0.86 CARM1 (0.61) CHRNB2CHRNA4CHRNA5CHRNA7CARM1
SCHEMBL532785 0.86 CARM1 (0.61) CHRNB2CHRNA4CHRNA5CHRNA7CARM1
SCHEMBL27340261 0.84 CARM1 (0.50) CHRNB2CHRNA4CHRNA5CHRNA7CARM1
SCHEMBL6557189 0.83 DRD2 (0.41) CHRNB2CHRNA4CHRNA5CHRNA7CARM1
SCHEMBL1548969 0.83 RAB9A (0.48) CHRNB2CHRNA4CHRNA5CHRNA7MAPK1
SCHEMBL28000863 0.82 CARM1 (0.48) CHRNB2CHRNA4CHRNA5CHRNA7CARM1

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-0977799-B1 ANTIBLOCK COATING FOR HOT MELT ADHESIVES EASTMAN CHEM CO (US) 2002-10-30 EP claimed
US-20020086154-A1 Antiblock coating for hot melt adhesives EASTMAN CHEMICAL COMPANY 2002-07-04 US claimed
US-6365271-B1 WHEN SHIPPED IN THE FORM OF PARTICLES; NONTACKY DIBENZOATE ESTER MOIETY, PARTICULARLY 1,4- OR 1,3-CYCLOHEXANEDIMETHANOL DIBENZOATE, SULFO-CONTAINING POLYESTER EASTMAN CHEMICAL COMPANY 2002-04-02 US claimed
EP-0977799-A1 ANTIBLOCK COATING FOR HOT MELT ADHESIVES EASTMAN CHEMICAL COMPANY (US) 2000-02-09 EP claimed
WO-1998050454-A1 ANTIBLOCK COATING FOR HOT MELT ADHESIVES EASTMAN CHEMICAL COMPANY (US) 1998-11-12 WO claimed