SCHEMBL6024797

SCHEMBL6024797

COC(=O)/C=C/c1cc(C(=O)O)ccc1N

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.48
▸ MAPT P10636 4/20 0.48
▸ KDM4E B2RXH2 4/20 0.48
▸ HPGD P15428 2/20 0.48
▸ MEN1 O00255 1/20 0.48
▸ TP53 P04637 1/20 0.48
▸ CYP1A2 P05177 1/20 0.48
▸ CYP2C9 P11712 1/20 0.48
▸ ALOX15 P16050 1/20 0.48
▸ CYP2C19 P33261 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ HSD17B10 Q99714 1/20 0.48
▸ PTGER4 P35408 1/20 0.43
▸ TTR P02766 1/20 0.42
▸ APP P05067 1/20 0.42
▸ CA12 O43570 2/20 0.41
▸ CA1 P00915 2/20 0.41
▸ CA2 P00918 2/20 0.41
▸ CA7 P43166 2/20 0.41
▸ CA9 Q16790 2/20 0.41

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
SCHEMBL6036480 1.00 ALDH1A1 (0.48) ALDH1A1MAPTKDM4EHPGDMEN1
SCHEMBL5392736 0.88 ALDH1A1 (0.51) ALDH1A1MAPTKDM4EHPGDMEN1
SCHEMBL5392742 0.88 ALDH1A1 (0.51) ALDH1A1MAPTKDM4EHPGDMEN1
SCHEMBL6169631 0.88 MAPT (0.48) ALDH1A1MAPTKDM4EHPGDMEN1
SCHEMBL6169905 0.81 ALDH1A1 (0.50) ALDH1A1MAPTKDM4EHPGDMEN1
SCHEMBL6169914 0.81 ALDH1A1 (0.50) ALDH1A1MAPTKDM4EHPGDMEN1
SCHEMBL6169288 0.81 ALDH1A1 (0.50) ALDH1A1MAPTKDM4EHPGDMEN1
SCHEMBL6169292 0.81 ALDH1A1 (0.50) ALDH1A1MAPTKDM4EHPGDMEN1
SCHEMBL3167942 0.80 MAPT (0.49) ALDH1A1MAPTKDM4EHPGDMEN1
SCHEMBL6170877 0.80 JUN (0.53) ALDH1A1MAPTKDM4EHPGDMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1513800-B1 N-BENZOYLUREIDOCINNAMATE DERIVATIVES, METHOD FOR PRODUCTION AND USE THEREOF SANOFI AVENTIS DEUTSCHLAND (DE) 2006-11-15 — — EP disclosed
US-7049341-B2 N-benzoylureidocinnamic acid derivatives, processes for preparing them and their use AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2006-05-23 — — US disclosed
EP-1513800-A1 N-BENZOYLUREIDOCINNAMATE DERIVATIVES, METHOD FOR PRODUCTION AND USE THEREOF Aventis Pharma Deutschland GmbH (DE) 2005-03-16 — — EP disclosed
US-20040102518-A1 N-benzoylureidocinnamic acid derivatives, processes for preparing them and their use AVENTIS PHARMA AG (DE) 2004-05-27 — — US disclosed
WO-2003104188-A1 N-BENZOYLUREIDOCINNAMATE DERIVATIVES, METHOD FOR PRODUCTION AND USE THEREOF AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2003-12-18 — — WO 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-20040102518-A1 N-benzoylureidocinnamic acid derivatives, processes for preparing them and their use SLC5A1, NQO1, SLC5A2 ALDH1A1 230/4885MAPT 4812/4885KDM4E 4123/4885

“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.

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