SCHEMBL9999680

SCHEMBL9999680

COCc1cc(COC)cc(Cc2cc(COC)cc(COC)c2)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.37
ALDH1A1 P00352 2/20 0.33
PRKCE Q02156 2/20 0.33
MYLK Q15746 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
MAPT P10636 2/20 0.33
MEN1 O00255 1/20 0.33
PRKCG P05129 1/20 0.33
PRKCA P17252 1/20 0.33
APEX1 P27695 1/20 0.33
RECQL P46063 1/20 0.33
KMT2A Q03164 1/20 0.33
GAA P10253 1/20 0.33
LMNA P02545 1/20 0.32
TP53 P04637 1/20 0.32
TUBB4A P04350 1/20 0.31
TUBB P07437 1/20 0.31
TUBA3C P0DPH7 1/20 0.31
TUBA1B P68363 1/20 0.31
TUBA4A P68366 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
SCHEMBL3624689 0.91 PRKCE (0.37) CA2ALDH1A1PRKCEMYLKTDP1
SCHEMBL25446802 0.82 PRKCE (0.46) ALDH1A1PRKCEMYLKTDP1MAPT
SCHEMBL12285411 0.82 CYP11B1 (0.38) CA2ALDH1A1PRKCEMYLKTDP1
SCHEMBL5237545 0.80 HSP90AB1 (0.46) CA2ALDH1A1PRKCEMYLKTDP1
SCHEMBL10015636 0.80 PTGS2 (0.46) ALDH1A1PRKCEMYLKTDP1MAPT
SCHEMBL10063636 0.80 PTGS2 (0.46) ALDH1A1PRKCEMYLKTDP1MAPT
SCHEMBL8256610 0.80 PGK1 (0.39) ALDH1A1POLB
SCHEMBL3587231 0.78 IDO1 (0.50) ALDH1A1PRKCEMYLKTDP1MAPT
SCHEMBL8281936 0.78 ALDH1A1 (0.35) CA2ALDH1A1PRKCEMYLKTDP1
SCHEMBL14949281 0.78 ACHE (0.48) ALDH1A1PRKCEMYLKTDP1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012014898-A1 LIQUID CRYSTAL ALIGNING AGENT, LIQUID CRYSTAL ALIGNMENT FILM, AND LIQUID CRYSTAL DISPLAY ELEMENT 日産化学工業株式会社 (JP) 2012-02-02 WO disclosed