SCHEMBL12442533

SCHEMBL12442533

CC(C)=CCCc1cccc(C=Cc2ncccn2)c1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 3/20 0.38
▸ PPARA Q07869 3/20 0.38
▸ CYP4F2 P78329 2/20 0.36
▸ CYP4A11 Q02928 2/20 0.36
▸ PLAU P00749 1/20 0.34
▸ AKR1C3 P42330 6/20 0.33
▸ AKR1C2 P52895 6/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ TSHR P16473 1/20 0.33
▸ HMGCR P04035 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ PKM P14618 1/20 0.32
▸ KDM1A O60341 1/20 0.32
▸ MAOA P21397 1/20 0.32
▸ MAOB P27338 1/20 0.32

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
SCHEMBL12653031 0.75 CLK4 (0.41) KDM4ETSHRALDH1A1
SCHEMBL12619266 0.71 HAO1 (0.37) AKR1C3KDM4ETSHR
SCHEMBL27499784 0.71 DRD2 (0.53) —
SCHEMBL29176133 0.69 TRPV1 (0.35) PPARGPPARA
SCHEMBL5442047 0.69 LCK (0.62) KDM1AMAOAMAOB
SCHEMBL5442049 0.69 LCK (0.62) KDM1AMAOAMAOB
SCHEMBL105976 0.68 TRPV1 (0.51) ALDH1A1
SCHEMBL29176132 0.67 TRPV1 (0.37) PPARGPPARA
SCHEMBL3084716 0.67 PTPN1 (0.52) PPARGPPARAALDH1A1MAOB
SCHEMBL3090448 0.67 PTPN1 (0.52) PPARGPPARAALDH1A1MAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9663687-B2 Adhesive composition, protective film for a polarizing plate, polarizing plate, and liquid crystal display LG CHEM, LTD. (KR) 2017-05-30 — — US disclosed
US-20110177262-A1 ADHESIVE COMPOSITION, PROTECTIVE FILM FOR A POLARIZING PLATE, POLARIZING PLATE, AND LIQUID CRYSTAL DISPLAY LG CHEM, LTD. (KR) 2011-07-21 — — US disclosed
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