SCHEMBL16201822

SCHEMBL16201822

COc1c(C)cc(Cn2c(=O)n(Cc3cc(C)c(OC)c(C)c3)c(=O)n(Cc3cc(C)c(OC)c(C)c3)c2=O)cc1C

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
C5AR1 P21730 1/20 0.41
ALDH1A1 P00352 3/20 0.40
DHFR P00374 1/20 0.37
PDE5A O76074 1/20 0.37
PDE4A P27815 1/20 0.37
PDE4B Q07343 1/20 0.37
PDE4C Q08493 1/20 0.37
PDE4D Q08499 1/20 0.37
NR3C1 P04150 1/20 0.36
NR3C2 P08235 1/20 0.36
KDM4E B2RXH2 1/20 0.36
MAPT P10636 1/20 0.36
ALOX15 P16050 1/20 0.36
KMT2A Q03164 1/20 0.36
CYP19A1 P11511 1/20 0.36
PPARG P37231 1/20 0.36
PPARD Q03181 1/20 0.36
PPARA Q07869 1/20 0.36

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
SCHEMBL16201609 0.91 ALDH1A1 (0.38) C5AR1ALDH1A1MAPTKMT2APPARG
SCHEMBL18800187 0.88 P2RX3 (0.40) C5AR1NR3C1NR3C2
SCHEMBL16200745 0.79 P2RX3 (0.43) C5AR1KMT2APPARDPPARA
SCHEMBL17042665 0.78 C5AR1 (0.38) C5AR1ALDH1A1KDM4EMAPTKMT2A
SCHEMBL4635049 0.75 C5AR1 (0.44) C5AR1KDM4EMAPTKMT2A
SCHEMBL13304653 0.73 DHFR (0.51) ALDH1A1DHFRNR3C1NR3C2
SCHEMBL8377139 0.72 PTGS2 (0.60) ALDH1A1DHFRNR3C1NR3C2
SCHEMBL4784297 0.71 ALDH1A1 (0.42) ALDH1A1DHFRNR3C1NR3C2
SCHEMBL16200756 0.71 C5AR1 (0.41) C5AR1KDM4EMAPTKMT2A
SCHEMBL23743654 0.70 ALDH1A1 (0.44) ALDH1A1DHFRNR3C1NR3C2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9642249-B2 Resin composition, prepreg, and substrate employing the same INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2017-05-02 US disclosed
US-9012572-B2 Polyphenylene ether oligomer and article employing the same INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2015-04-21 US disclosed
US-20140322545-A1 RESIN COMPOSITION, PREPREG, AND SUBSTRATE EMPLOYING THE SAME INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2014-10-30 US disclosed
US-20140323666-A1 POLYPHENYLENE ETHER OLIGOMER AND ARTICLE EMPLOYING THE SAME INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2014-10-30 US disclosed