SCHEMBL666919

SCHEMBL666919

COC(=O)C(C)=CC(C)C

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.40
TSHR P16473 1/20 0.36
KEAP1 Q14145 1/20 0.32
NFE2L2 Q16236 1/20 0.32
HCAR2 Q8TDS4 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
MAP3K7 O43318 1/20 0.31
TAB1 Q15750 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
SCHEMBL9654192 1.00 ALDH1A1 (0.40) ALDH1A1TSHRKEAP1NFE2L2HCAR2
SCHEMBL3200879 0.83 ALDH1A1 (0.39) ALDH1A1TSHRKEAP1NFE2L2HCAR2
SCHEMBL3200874 0.83 ALDH1A1 (0.39) ALDH1A1TSHRKEAP1NFE2L2HCAR2
SCHEMBL27542945 0.83 ALDH1A1 (0.39) ALDH1A1TSHRKEAP1NFE2L2HCAR2
SCHEMBL1896116 0.81 ALDH1A1 (0.37) ALDH1A1TSHRMAP3K7TAB1
SCHEMBL3993695 0.80 TSHR (0.36) TSHR
SCHEMBL10898119 0.80 TSHR (0.36) TSHR
SCHEMBL10687993 0.80 TSHR (0.48) ALDH1A1TSHRHCAR2SMN1; SMN2
SCHEMBL12391156 0.79 ALDH1A1 (0.36) ALDH1A1TSHR
SCHEMBL31117771 0.78 ALDH1A1 (0.33) ALDH1A1KEAP1NFE2L2HCAR2SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107210376-B Ink composition for organic light-emitting element and organic light-emitting element DIC株式会社 2019-06-28 CN disclosed
US-8728366-B2 Method and device for making an optical plate formed with a microstructure CHI MEI CORPORATION (TW) 2014-05-20 US disclosed
US-20120286436-A1 TWO-SIDED MICROSTRUCTURE FORMING DEVICE AND METHOD FOR FORMING AN OPTICAL PLATE CHI MEI CORPORATION (TW) 2012-11-15 US disclosed
US-20120043679-A1 METHOD AND DEVICE FOR MAKING AN OPTICAL PLATE FORMED WITH A MICROSTRUCTURE CHI MEI CORPORATION (TW) 2012-02-23 US disclosed
US-7678740-B2 Avermectin and avermectin monosaccharide derivatives substituted in the 4″-or 4′-position having pesticidal properties MERIAL LIMITED (US) 2010-03-16 US disclosed
CN-101321824-A Flame retardant polymer composition 3M INNOVATIVE PROPERTIES CO (US) 2008-12-10 CN disclosed
US-7378399-B2 Avermectins substituted in the 4″ and 4′-positions having pesticidal properties MERIAL LIMITED (US) 2008-05-27 US disclosed
EP-0446759-B1 Process for the production of cyclopentenones BASF AG (DE) 1994-07-27 EP disclosed
US-5118864-A PREPARATION OF CYCLOPENTENONES BASF AKTIENGESELLSCHAFT (DE) 1992-06-02 US disclosed
EP-0446759-A1 Process for the production of cyclopentenones BASF Aktiengesellschaft (DE) 1991-09-18 EP disclosed