SCHEMBL6716355

SCHEMBL6716355

CCOC(=O)C(Cc1ccc(OCCNC(=O)OC(C)(C)C)c([N+](=O)[O-])c1)Oc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
KDM4E B2RXH2 4/20 0.41
TDP1 Q9NUW8 2/20 0.41
HTT P42858 1/20 0.40
BCL2 P10415 1/20 0.39
BCHE P06276 1/20 0.39
CNR2 P34972 1/20 0.39
MAPT P10636 1/20 0.39
IDO1 P14902 1/20 0.39
POLB P06746 1/20 0.39
KCNH2 Q12809 1/20 0.39
PDCD1 Q15116 1/20 0.38
CD274 Q9NZQ7 1/20 0.38

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
SCHEMBL6717706 0.93 ALDH1A1 (0.43) ALDH1A1KDM4ETDP1HTTBCL2
SCHEMBL6722536 0.86 IDO1 (0.41) ALDH1A1L3MBTL1KDM4EMAPTIDO1
SCHEMBL6717857 0.86 PPARG (0.43) ALDH1A1L3MBTL1KDM4EHTTMAPT
SCHEMBL6716385 0.80 PPARG (0.49) ALDH1A1L3MBTL1HTTMAPTPOLB
SCHEMBL6716377 0.79 IDO1 (0.42) ALDH1A1IDO1
SCHEMBL6714907 0.79 PPARG (0.47) ALDH1A1KDM4EHTTIDO1POLB
SCHEMBL6715220 0.77 CA12 (0.50) L3MBTL1MAPT
SCHEMBL6713079 0.76 PPARG (0.43) ALDH1A1L3MBTL1KDM4EMAPT
SCHEMBL6716329 0.75 CA12 (0.48) ALDH1A1L3MBTL1KDM4EMAPTPOLB
SCHEMBL6713248 0.75 CA12 (0.48)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040006141-A1 Amidocarboxylic acid compounds SANKYO COMPANY, LTD (JP) 2004-01-08 US disclosed
US-6528525-B1 Amidocarboxylic acid derivatives SANKYO COMPANY, LIMITED (JP) 2003-03-04 US disclosed
CN-1280561-A Amidocarboxylic acid derivatives SANKYO CO (JP) 2001-01-17 CN disclosed
EP-1026149-A1 AMIDOCARBOXYLIC ACID DERIVATIVES Sankyo Company Limited (JP) 2000-08-09 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040006141-A1 Amidocarboxylic acid compounds NR1H2, AGK, APOL1 ALDH1A1 3508/4885L3MBTL1 1431/4885KDM4E 4633/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.