SCHEMBL19296353

SCHEMBL19296353

CCCCCC(=O)c1cc(O)c(C)c(O)c1OC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.49
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
PAK1 Q13153 1/20 0.48
PLA2G2A P14555 2/20 0.48
PLA2G5 P39877 2/20 0.48
FFAR1 O14842 1/20 0.48
ALOX5 P09917 4/20 0.43
FASN P49327 1/20 0.43
ALDH1A1 P00352 2/20 0.41
HPGD P15428 1/20 0.41
ALOX15 P16050 1/20 0.41
TSHR P16473 1/20 0.41
RECQL P46063 1/20 0.41
HSD17B10 Q99714 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
MAPT P10636 1/20 0.41
ATM Q13315 1/20 0.41
ELANE P08246 2/20 0.41
TRPV1 Q8NER1 1/20 0.40

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
SCHEMBL19296354 0.90 HTT (0.50) HTTMEN1KMT2APAK1PLA2G2A
SCHEMBL21047128 0.83 HTT (0.55) HTTMEN1KMT2APAK1PLA2G2A
SCHEMBL19296351 0.82 PLA2G2A (0.57) HTTMEN1KMT2APAK1PLA2G2A
SCHEMBL11075491 0.79 PLA2G2A (0.57) HTTMEN1KMT2APAK1PLA2G2A
SCHEMBL9210604 0.74 HTT (0.59) HTTMEN1KMT2APLA2G2APLA2G5
SCHEMBL11298663 0.74 HTT (0.43) HTTMEN1KMT2APLA2G2APLA2G5
SCHEMBL11301129 0.71 HTT (0.59) HTTMEN1KMT2APLA2G2APLA2G5
SCHEMBL10605850 0.71 THRA (0.57) MEN1KMT2APAK1PLA2G2APLA2G5
SCHEMBL11079724 0.71 HTT (0.59) HTTMEN1KMT2APLA2G2APLA2G5
SCHEMBL3662392 0.71 HTT (0.72) HTTMEN1KMT2AALDH1A1HPGD

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-2017145958-A1 WHITENING AGENT COMPRISING AS ACTIVE AGENT SYZYGIUM POLYANTHUM OR AN EXTRACT THEREOF KAO CORPORATION (JP) 2017-08-31 WO disclosed