SCHEMBL28171663

SCHEMBL28171663

O=C(Cc1ccccc1)c1nc2ccccc2o1

nearest known ligand 0.66

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DAGLA Q9Y4D2 6/20 0.66
FAAH O00519 4/20 0.66
CES1 P23141 2/20 0.66
XDH P47989 5/20 0.64
SMN1; SMN2 Q16637 2/20 0.51
ALDH1A1 P00352 1/20 0.51
GAA P10253 1/20 0.51
NPC1 O15118 2/20 0.48
HPGD P15428 2/20 0.48
RAB9A P51151 2/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
KDM4E B2RXH2 1/20 0.47
POLB P06746 1/20 0.47
CSNK1D P48730 1/20 0.47

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
SCHEMBL8766789 0.81 FAAH (0.58) DAGLAFAAHCES1XDHSMN1; SMN2
SCHEMBL11937009 0.80 FAAH (0.59) DAGLAFAAHCES1XDHSMN1; SMN2
SCHEMBL1590095 0.79 FAAH (0.55) DAGLAFAAHCES1XDHSMN1; SMN2
SCHEMBL17951858 0.79 FAAH (0.54) DAGLAFAAHCES1XDHALDH1A1
Hydrochloric Acid SCHEMBL23320558 0.78 FAAH (0.54) DAGLAFAAHCES1XDHSMN1; SMN2
SCHEMBL3612583 0.78 FAAH (0.54) DAGLAFAAHCES1XDHSMN1; SMN2
SCHEMBL30788888 0.77 DAGLA (0.62) DAGLAFAAHCES1XDHALDH1A1
SCHEMBL100961 0.77 FAAH (0.55) DAGLAFAAHCES1XDHSMN1; SMN2
SCHEMBL14562869 0.77 FAAH (0.67) DAGLAFAAHCES1XDHSMN1; SMN2
SCHEMBL14110503 0.77 DAGLA (0.62) DAGLAFAAHCES1XDHALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107188864-B A kind of N- benzyl benzoxazoles ketone compound and its synthetic method 安徽师范大学 2019-06-04 CN claimed
CN-107188864-A A kind of N benzyls benzoxazole ketones compound and its synthetic method 安徽师范大学 2017-09-22 CN claimed
CN-107188864-B A kind of N- benzyl benzoxazoles ketone compound and its synthetic method 安徽师范大学 2019-06-04 CN disclosed
CN-107188864-B A kind of N- benzyl benzoxazoles ketone compound and its synthetic method 安徽师范大学 2019-06-04 CN disclosed
CN-107188864-B A kind of N- benzyl benzoxazoles ketone compound and its synthetic method 安徽师范大学 2019-06-04 CN disclosed
CN-107188864-A A kind of N benzyls benzoxazole ketones compound and its synthetic method 安徽师范大学 2017-09-22 CN disclosed
CN-107188864-A A kind of N benzyls benzoxazole ketones compound and its synthetic method 安徽师范大学 2017-09-22 CN disclosed