SCHEMBL27925520

SCHEMBL27925520

CCOC(=O)c1ccnc(Oc2ccc(OCC)cc2)c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 1/20 0.53
MAPT P10636 3/20 0.50
KMT2A Q03164 2/20 0.50
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
MEN1 O00255 1/20 0.50
JMJD6 Q6NYC1 3/20 0.49
LMNA P02545 1/20 0.49
TSHR P16473 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
PIK3CA P42336 1/20 0.47
PKM P14618 1/20 0.46
F2 P00734 1/20 0.45
F10 P00742 1/20 0.45
LOXL2 Q9Y4K0 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
PTGS2 P35354 1/20 0.45
CA12 O43570 1/20 0.44

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
SCHEMBL3723629 0.85 JMJD6 (0.56) GPR119JMJD6LMNAPIK3CACA12
SCHEMBL19877858 0.81 MAPT (0.53) MAPTKMT2ASMN1; SMN2MEN1LMNA
SCHEMBL7456502 0.81 JMJD6 (0.55) GPR119JMJD6LMNAPIK3CACA12
SCHEMBL930833 0.77 MEN1 (0.62) MAPTKMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL4410496 0.77 PIK3CA (0.52) GPR119SMN1; SMN2JMJD6LMNAPIK3CA
SCHEMBL4090687 0.77 JMJD6 (0.51) GPR119KMT2AJMJD6PIK3CACA12
SCHEMBL76052 0.77 ALDH1A1 (0.66) MAPTNPC1LMNATDP1L3MBTL1
SCHEMBL29505420 0.76 MAOB (0.58) MAPTKMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL19510738 0.76 MAOB (0.58) MAPTKMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL5349967 0.76 PTGS2 (0.60) MAPTKMT2ANPC1RAB9ASMN1; 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105685064-A HERBICIDAL ISOXAZOLO[5,4-b]PYRIDINES 巴斯夫欧洲公司 2016-06-22 CN claimed
CN-103124733-B Herbicidal isoxazolo [5,4-b ] pyridines BASF SE (DE) 2016-03-30 CN claimed
CN-103124733-A Herbicidal isoxazolo [5,4-b ] pyridines BASF SE 2013-05-29 CN claimed
CN-105685064-A HERBICIDAL ISOXAZOLO[5,4-b]PYRIDINES 巴斯夫欧洲公司 2016-06-22 CN disclosed
CN-103124733-B Herbicidal isoxazolo [5,4-b ] pyridines BASF SE (DE) 2016-03-30 CN disclosed
CN-103124733-A Herbicidal isoxazolo [5,4-b ] pyridines BASF SE 2013-05-29 CN disclosed