SCHEMBL18924496

SCHEMBL18924496

COc1ccc(C(O)c2ccccc2)c(OC)c1OC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 2/20 0.49
CNR2 P34972 1/20 0.44
PKM P14618 1/20 0.43
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
MAPT P10636 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
MAPK1 P28482 1/20 0.41
CYP2C9 P11712 1/20 0.40
IDO1 P14902 1/20 0.40
TDO2 P48775 1/20 0.40
ALOX5 P09917 1/20 0.40
HDAC4 P56524 1/20 0.40
HDAC2 Q92769 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
ATM Q13315 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
ALDH1A1 P00352 1/20 0.39
POLB P06746 1/20 0.39

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
SCHEMBL29105289 0.86 MAPT (0.51) CNR2MEN1KMT2AMAPTSMN1; SMN2
SCHEMBL18287882 0.85 AOC3 (0.57) AOC3MEN1KMT2AMAPTSMN1; SMN2
SCHEMBL6897763 0.83 TUBB4A (0.51) AOC3MAPTSMN1; SMN2
SCHEMBL30273872 0.80 IDO1 (0.55) CNR2MEN1KMT2AMAPTSMN1; SMN2
SCHEMBL30476555 0.80 IDO1 (0.55) CNR2MEN1KMT2AMAPTSMN1; SMN2
SCHEMBL477540 0.80 IDO1 (0.55) CNR2MEN1KMT2AMAPTSMN1; SMN2
SCHEMBL30986735 0.80 IDO1 (0.55) CNR2MEN1KMT2AMAPTSMN1; SMN2
SCHEMBL3862578 0.80 IDO1 (0.55) CNR2MEN1KMT2AMAPTSMN1; SMN2
SCHEMBL28043480 0.76 CNR2 (0.48) CNR2MEN1KMT2AMAPTSMN1; SMN2
SCHEMBL28276198 0.75 CNR2 (0.62) CNR2MEN1KMT2AMAPTSMN1; SMN2

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
US-9670121-B2 Diphenylmethane compound AJINOMOTO CO., INC. (JP) 2017-06-06 US disclosed