SCHEMBL4779978

SCHEMBL4779978

CCOc1nc2cccc(CC(=O)O)c2[nH]1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 1/20 0.43
GRIN3B O60391 1/20 0.43
GRIN1 Q05586 1/20 0.43
GRIN2A Q12879 1/20 0.43
GRIN2B Q13224 1/20 0.43
GRIN2C Q14957 1/20 0.43
GRIN3A Q8TCU5 1/20 0.43
KDM4C Q9H3R0 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
STING1 Q86WV6 1/20 0.38
KDM4E B2RXH2 2/20 0.37
CYP1A2 P05177 1/20 0.37
MAPT P10636 1/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
ALDH1A1 P00352 1/20 0.37
ELANE P08246 4/20 0.36
HSD17B10 Q99714 1/20 0.36
PLA2G2A P14555 1/20 0.36
PRMT5 O14744 1/20 0.36

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
SCHEMBL23337439 0.87 KDM4E (0.44) KDM4CTDP1KDM4EMAPTALDH1A1
SCHEMBL4725858 0.87 HDAC6 (0.42) KDM4CKDM4EMAPTALDH1A1ELANE
SCHEMBL4725397 0.81 KDM5B (0.43) KDM4CKDM4ECYP1A2ALDH1A1HSD17B10
SCHEMBL5271758 0.76 KDM4E (0.44) KDM4CTDP1KDM4EMAPTMEN1
SCHEMBL7260709 0.76 TSHR (0.49) KDM4ECYP1A2MAPTALDH1A1HSD17B10
SCHEMBL9587963 0.76 GRIN2D (0.49) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL4365104 0.75 ELANE (0.42) KDM4CALDH1A1ELANEGUSB
SCHEMBL28172168 0.75 KDM4C (0.42) KDM4CKDM4EMAPTMEN1KMT2A
SCHEMBL8298123 0.74 TLR8 (0.43) KDM4CKMT2AALDH1A1ELANEGUSB
SCHEMBL4356909 0.74 KDM4C (0.41) KDM4CALDH1A1ELANEL3MBTL1

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
WO-2008012852-A1 INTERMEDIATE COMPOUNDS FOR THE PREPARATION OF ANGIOTENSIN II ANTAGONISTS S.I.M.S. S.r.l. - SOCIETÀ ITALIANA MEDICINALI SCANDICCI (IT) 2008-01-31 WO claimed
CN-105669495-A Novel preparation method for azilsartan and intermediate thereof 重庆朗天制药有限公司 2016-06-15 CN disclosed
WO-2008012852-A1 INTERMEDIATE COMPOUNDS FOR THE PREPARATION OF ANGIOTENSIN II ANTAGONISTS S.I.M.S. S.r.l. - SOCIETÀ ITALIANA MEDICINALI SCANDICCI (IT) 2008-01-31 WO disclosed