SCHEMBL8977004

SCHEMBL8977004

C=Cc1ccc(OC=CC)cc1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.48
CHRNB2 P17787 1/20 0.41
CHRNB4 P30926 1/20 0.41
CHRNA3 P32297 1/20 0.41
CHRNA7 P36544 1/20 0.41
CHRNA4 P43681 1/20 0.41
TSHR P16473 2/20 0.39
TP53 P04637 2/20 0.39
CYP3A4 P08684 2/20 0.39
LMNA P02545 1/20 0.39
KDM4E B2RXH2 1/20 0.39
HDAC8 Q9BY41 1/20 0.37
TDP1 Q9NUW8 2/20 0.33
TRPA1 O75762 1/20 0.33
CYP2A6 P11509 1/20 0.31
MAPT P10636 1/20 0.30
CYP2C9 P11712 1/20 0.30
ALOX15 P16050 1/20 0.30
CYP2C19 P33261 1/20 0.30

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
SCHEMBL8977000 1.00 ALDH1A1 (0.48) ALDH1A1CHRNB2CHRNB4CHRNA3CHRNA7
SCHEMBL5612605 0.83 LMNA (0.39) ALDH1A1CHRNB2CHRNA4TSHRTP53
SCHEMBL9133041 0.77 ESR2 (0.36) ALDH1A1CHRNB2CHRNA4TSHRTP53
SCHEMBL126186 0.77 ALDH1A1 (0.58) ALDH1A1CHRNB2CHRNB4CHRNA3CHRNA7
SCHEMBL9065756 0.73 LMNA (0.38) ALDH1A1TSHRTP53CYP3A4LMNA
SCHEMBL11136720 0.73 TDP1 (0.48) ALDH1A1TSHRCYP3A4TDP1MAPT
SCHEMBL3791268 0.73 CYP2A6 (0.38) ALDH1A1CHRNA7TSHRTP53CYP3A4
SCHEMBL30046823 0.73 NFE2L2 (0.43) ALDH1A1TSHRTP53CYP3A4LMNA
SCHEMBL11136726 0.73 TDP1 (0.48) ALDH1A1TSHRCYP3A4TDP1MAPT
SCHEMBL9216513 0.73 MEN1 (0.46) ALDH1A1TP53CYP3A4LMNAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-6220297-A None JP disclosed
EP-0490588-B1 A method of forming high-temperature resistant polymers LOCTITE IRELAND LTD (IE) 1996-04-24 EP disclosed
EP-0490589-B1 Styryloxy compounds and polymers thereof LOCTITE IRELAND LTD (IE) 1995-03-08 EP disclosed
JP-H06220297-A METHOD OF FORMING HIGH-TEMPERATURE RESISTANT POLYMER LOCTITE IRELAND LTD 1994-08-09 JP disclosed
US-5141970-A Photocuring an ether-ring substituted styrene and heating the Claisen-rearranged product to crosslink LOCTITE (IRELAND) LIMITED (IE) 1992-08-25 US disclosed
EP-0490589-A1 Styryloxy compounds and polymers thereof LOCTITE (IRELAND) Ltd. (IE) 1992-06-17 EP disclosed
EP-0490588-A1 A method of forming high-temperature resistant polymers LOCTITE (IRELAND) Ltd. (IE) 1992-06-17 EP disclosed
US-5084490-A Polymers for use in surface coatings, films, inks, adhesives and seals LOCTITE (IRELAND) LIMITED (IE) 1992-01-28 US disclosed