SCHEMBL9113643

SCHEMBL9113643

O=C(CCCCCCO)N1CCOCC1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLA P06280 2/20 0.57
L3MBTL1 Q9Y468 3/20 0.55
RAB9A P51151 4/20 0.53
LMNA P02545 2/20 0.49
TSHR P16473 2/20 0.49
POLB P06746 2/20 0.49
USP2 O75604 2/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
ALDH1A1 P00352 2/20 0.47
FKBP1A P62942 1/20 0.47
KDM4E B2RXH2 2/20 0.47
HPGD P15428 2/20 0.47
TDP1 Q9NUW8 1/20 0.47
ATM Q13315 1/20 0.47
ALOX15 P16050 1/20 0.46
HSD17B10 Q99714 1/20 0.46
NPC1 O15118 2/20 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
SCHEMBL9160397 1.00 GLA (0.57) GLAL3MBTL1RAB9ALMNATSHR
SCHEMBL6043811 0.98 GLA (0.59) GLAL3MBTL1RAB9ALMNATSHR
SCHEMBL6043075 0.92 GLA (0.61) GLAL3MBTL1RAB9ALMNATSHR
SCHEMBL7694058 0.92 GLA (0.65) GLAL3MBTL1RAB9ALMNATSHR
SCHEMBL9415751 0.90 GLA (0.67) GLAL3MBTL1RAB9ALMNATSHR
SCHEMBL27415961 0.85 GLA (0.57) GLAL3MBTL1RAB9ALMNATSHR
SCHEMBL9113633 0.85 GLA (0.57) GLAL3MBTL1RAB9ALMNATSHR
SCHEMBL3404224 0.84 L3MBTL1 (0.63) GLAL3MBTL1RAB9ALMNATSHR
SCHEMBL8971899 0.83 L3MBTL1 (0.67) GLAL3MBTL1RAB9ALMNATSHR
SCHEMBL474080 0.83 L3MBTL1 (0.67) GLAL3MBTL1RAB9ALMNATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1114834-A antidiabetic agent OTSUKA PHARMA CO LTD (JP) 1996-01-10 CN disclosed
EP-0670831-A1 QUINOXALINE DERIVATIVE AS ANTIDIABETIC AGENT OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1995-09-13 EP disclosed
WO-1995009159-A1 QUINOXALINE DERIVATIVE AS ANTIDIABETIC AGENT OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 1995-04-06 WO disclosed