SCHEMBL16486240

SCHEMBL16486240

O=C(Nc1ccc2c(c1)OCO2)c1cc(-c2ccccc2)on1

nearest known ligand 0.95

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.95
MAPT P10636 8/20 0.80
NPC1 O15118 4/20 0.80
RAB9A P51151 4/20 0.80
KLK7 P49862 1/20 0.80
KMT2A Q03164 7/20 0.79
MEN1 O00255 6/20 0.79
GAA P10253 1/20 0.79
RXFP1 Q9HBX9 3/20 0.69
SMN1; SMN2 Q16637 2/20 0.69
KLF5 Q13887 1/20 0.69
THRB P10828 2/20 0.68
ALDH1A1 P00352 1/20 0.67
TP53 P04637 1/20 0.65
NFKB1 P19838 1/20 0.65
NFKB2 Q00653 1/20 0.65
RELA Q04206 1/20 0.65

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
SCHEMBL16486232 0.88 KMT2A (0.87) FAAHMAPTNPC1RAB9AKLK7
SCHEMBL17318627 0.83 FAAH (0.69) FAAHMAPTNPC1RAB9AKLK7
SCHEMBL16486184 0.80 KMT2A (1.00) FAAHMAPTNPC1RAB9AKMT2A
SCHEMBL17731989 0.79 MAPT (0.67) FAAHMAPTNPC1KMT2AMEN1
SCHEMBL15427025 0.79 SMN1; SMN2 (1.00) FAAHMAPTNPC1RAB9AKLK7
SCHEMBL13901818 0.78 FAAH (0.61) FAAHMAPTNPC1RAB9AKMT2A
SCHEMBL6295679 0.77 NPC1 (1.00) MAPTNPC1RAB9AKMT2AMEN1
SCHEMBL17732020 0.77 NPC1 (0.74) FAAHMAPTNPC1RAB9AKMT2A
SCHEMBL15867670 0.77 NPC1 (1.00) FAAHMAPTNPC1RAB9AKLK7
SCHEMBL21523629 0.77 SCD5 (1.00) FAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015021943-A9 INDUCING NEUROGENESIS BY AXIN ENHANCER THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2015-12-30 WO disclosed
WO-2015021943-A1 INDUCING NEUROGENESIS BY AXIN ENHANCER THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2015-02-19 WO disclosed