SCHEMBL18073402

SCHEMBL18073402

COCc1cc(CO)cc(COCc2cc(CO)cc(COC)c2O)c1O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCE Q02156 3/20 0.44
MAPT P10636 3/20 0.44
MYLK Q15746 2/20 0.44
TDP1 Q9NUW8 2/20 0.44
ALDH1A1 P00352 2/20 0.44
MEN1 O00255 1/20 0.44
PRKCG P05129 1/20 0.44
PRKCA P17252 1/20 0.44
APEX1 P27695 1/20 0.44
RECQL P46063 1/20 0.44
KMT2A Q03164 1/20 0.44
ACHE P22303 1/20 0.41
KDM4E B2RXH2 1/20 0.41
CASP6 P55212 1/20 0.41
SHBG P04278 1/20 0.40
POLB P06746 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
HSD17B3 P37058 1/20 0.32
CYP4F2 P78329 1/20 0.32
CYP4A11 Q02928 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
SCHEMBL14949891 0.81 PRKCE (0.52) PRKCEMAPTMYLKTDP1ALDH1A1
SCHEMBL1919545 0.79 PRKCE (0.50) PRKCEMAPTMYLKTDP1ALDH1A1
SCHEMBL16850503 0.78 PRKCE (0.46) PRKCEMAPTMYLKTDP1ALDH1A1
SCHEMBL18810424 0.78 PRKCE (0.48) PRKCEMAPTMYLKTDP1ALDH1A1
SCHEMBL17702500 0.78 SHBG (0.59) MAPTALDH1A1ACHEKDM4ECASP6
SCHEMBL16257501 0.76 PRKCE (0.47) PRKCEMAPTMYLKTDP1ALDH1A1
SCHEMBL19600596 0.76 PRKCE (0.43) PRKCEMAPTMYLKTDP1ALDH1A1
SCHEMBL17752159 0.75 MAPT (0.44) MAPTACHEKDM4ECASP6SHBG
SCHEMBL3063768 0.74 PRKCE (0.54) PRKCEMAPTMYLKTDP1ALDH1A1
SCHEMBL26132797 0.74 PRKCE (0.54) PRKCEMAPTMYLKTDP1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10377912-B2 Container coating compositions PPG INDUSTRIES OHIO, INC. (US) 2019-08-13 US disclosed
US-20160264811-A1 CONTAINER COATING COMPOSITIONS PPG INDUSTRIES OHIO, INC. (US) 2016-09-15 US disclosed
US-20160264811-A1 CONTAINER COATING COMPOSITIONS PPG INDUSTRIES OHIO, INC. (US) 2016-09-15 US disclosed