SCHEMBL7563204

SCHEMBL7563204

C=CCOC(=O)/C=C(\CC=C)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.41
CACNA1B Q00975 1/20 0.41
APBA1 Q02410 1/20 0.41
CYP3A4 P08684 1/20 0.35
APP P05067 1/20 0.34
TSHR P16473 2/20 0.33
PKM P14618 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HSD17B10 Q99714 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL2936820 0.85 MAPT (0.41) MAPTCACNA1BAPBA1CYP3A4APP
SCHEMBL2938493 0.85 MAPT (0.41) MAPTCACNA1BAPBA1CYP3A4APP
SCHEMBL2936821 0.85 MAPT (0.41) MAPTCACNA1BAPBA1CYP3A4APP
SCHEMBL6047069 0.80 KDM4E (0.31) TSHR
SCHEMBL8172896 0.76 TSHR (0.35) MAPTCACNA1BAPBA1CYP3A4APP
SCHEMBL910007 0.74 KDM4E (0.52) TSHRHSD17B10
SCHEMBL910009 0.74 KDM4E (0.52) TSHRHSD17B10
SCHEMBL4640514 0.74 KDM4E (0.52) TSHRHSD17B10
SCHEMBL1075820 0.74 MAPT (0.42) MAPTCACNA1BAPBA1CYP3A4APP
SCHEMBL3902728 0.73 CYP3A4 (0.35) MAPTCACNA1BAPBA1CYP3A4TSHR

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-1144750-A3 POLY(VINYL ALCOHOL) COPOLYMER IONOMERS, THEIR PREPARATION AND USE IN TEXTILE SIZES E.I. DU PONT DE NEMOURS AND COMPANY (US) 2002-09-11 EP claimed
EP-1144750-A2 POLY(VINYL ALCOHOL) COPOLYMER IONOMERS, THEIR PREPARATION AND USE IN TEXTILE SIZES E.I. DU PONT DE NEMOURS AND COMPANY (US) 2001-10-17 EP claimed
WO-2000001876-A2 POLY(VINYL ALCOHOL) COPOLYMER IONOMERS, THEIR PREPARATION AND USE IN TEXTILE SIZES E.I. DU PONT DE NEMOURS AND COMPANY (US) 2000-01-13 WO claimed
EP-1203117-A1 POLY(VINYL ALCOHOL) COPOLYMER IONOMERS, THEIR PREPARATION AND USE IN TEXTILE SIZES E.I. DU PONT DE NEMOURS AND COMPANY (US) 2002-05-08 EP disclosed
WO-2001011136-A1 POLY(VINYL ALCOHOL) COPOLYMER IONOMERS, THEIR PREPARATION AND USE IN TEXTILE SIZES E.I. DU PONT DE NEMOURS AND COMPANY (US) 2001-02-15 WO disclosed