SCHEMBL28080298

SCHEMBL28080298

C=C(C)Oc1ccc(O)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 2/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
ESR1 P03372 1/20 0.48
LTA4H P09960 4/20 0.44
ELANE P08246 2/20 0.42
NR1H2 P55055 1/20 0.41
BAX Q07812 1/20 0.41
MAPT P10636 3/20 0.40
KDM4E B2RXH2 2/20 0.40
HSD17B10 Q99714 2/20 0.40
LMNA P02545 2/20 0.40
GAA P10253 2/20 0.40
THRB P10828 1/20 0.40
HTT P42858 1/20 0.40
GFER P55789 1/20 0.40
GPR55 Q9Y2T6 1/20 0.40
NPC1 O15118 1/20 0.40
CA12 O43570 1/20 0.40
GMNN O75496 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
SCHEMBL11144108 0.89 LMNA (0.44) MEN1KMT2AELANEMAPTKDM4E
SCHEMBL25732405 0.86 ESR2 (0.59) ESR2MEN1KMT2AESR1LTA4H
SCHEMBL3118881 0.84 ELANE (0.63) ELANEMAPTLMNAGAAHTT
SCHEMBL12755716 0.81 LTA4H (0.46) ESR2MEN1KMT2AESR1LTA4H
SCHEMBL10040398 0.81 KMT2A (0.46) ESR2MEN1KMT2AESR1MAPT
SCHEMBL12862164 0.80 CA1 (0.55) ESR2LTA4HMAPTKDM4ELMNA
SCHEMBL10725365 0.80 LMNA (0.60) MEN1KMT2AMAPTKDM4ELMNA
SCHEMBL12644763 0.78 NFE2L2 (0.39) KMT2AELANEKDM4ELMNAALDH1A1
SCHEMBL20036375 0.78 TDP1 (0.48) MEN1KMT2AMAPTKDM4EGAA
Water SCHEMBL11798439 0.78 LMNA (0.58) MEN1KMT2AMAPTKDM4ELMNA

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
CN-103923133-B A kind of method preparing alpha-arbutin 大兴安岭林格贝寒带生物科技股份有限公司 2016-08-31 CN disclosed