SCHEMBL3989879

SCHEMBL3989879

Oc1ccc(-c2ccc(O)cc2C=Cc2ccccc2)c(C=Cc2ccccc2)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.53
PELI1 Q96FA3 2/20 0.53
BACE1 P56817 1/20 0.51
PTPN1 P18031 1/20 0.47
NFE2L2 Q16236 1/20 0.47
ALOX5 P09917 2/20 0.46
TTR P02766 1/20 0.46
PTGS1 P23219 1/20 0.46
PTGS2 P35354 1/20 0.46
KDM4E B2RXH2 1/20 0.45
MEN1 O00255 1/20 0.45
ALDH1A1 P00352 1/20 0.45
CYP3A4 P08684 1/20 0.45
MAPT P10636 1/20 0.45
THRB P10828 1/20 0.45
HPGD P15428 1/20 0.45
ALOX15 P16050 1/20 0.45
MAPK1 P28482 1/20 0.45
KMT2A Q03164 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45

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
SCHEMBL8960569 0.84 TRPA1 (0.64) TRPA1PELI1BACE1PTPN1ALOX5
SCHEMBL31711219 0.84 TRPA1 (0.64) TRPA1PELI1BACE1PTPN1ALOX5
SCHEMBL3987824 0.84 PELI1 (0.67) TRPA1PELI1PTPN1NFE2L2ALOX5
SCHEMBL9742495 0.84 TRPA1 (0.64) TRPA1PELI1BACE1PTPN1ALOX5
SCHEMBL8796686 0.81 ALOX5 (0.56) TRPA1PELI1PTPN1NFE2L2ALOX5
SCHEMBL31006918 0.80 TYR (0.69) TRPA1PELI1BACE1PTPN1ALOX5
SCHEMBL1823527 0.80 TYR (0.69) TRPA1PELI1BACE1PTPN1ALOX5
SCHEMBL1061786 0.80 TYR (0.69) TRPA1PELI1BACE1PTPN1ALOX5
SCHEMBL9683193 0.79 PELI1 (0.49) TRPA1PELI1PTPN1NFE2L2ALOX5
SCHEMBL9307629 0.79 PELI1 (0.49) TRPA1PELI1PTPN1NFE2L2ALOX5

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
US-7538177-B2 Crosslinkable fluorinated aromatic prepolymer and its uses ASAHI GLASS COMPANY, LIMITED (JP) 2009-05-26 US claimed
EP-1897897-B1 CROSSLINKABLE FLUORINE-CONTAINING AROMATIC PREPOLYMER AND USE THEREOF ASAHI GLASS CO LTD (JP) 2015-05-27 EP disclosed
US-7538177-B2 Crosslinkable fluorinated aromatic prepolymer and its uses ASAHI GLASS COMPANY, LIMITED (JP) 2009-05-26 US disclosed
US-20080132669-A1 CROSSLINKABLE FLUORINATED AROMATIC PREPOLYMER AND ITS USES ASAHI GLASS COMPANY, LIMITED (JP) 2008-06-05 US disclosed
EP-1897897-A1 CROSSLINKABLE FLUORINE-CONTAINING AROMATIC PREPOLYMER AND USE THEREOF Asahi Glass Company, Limited (JP) 2008-03-12 EP disclosed