SCHEMBL7250986

SCHEMBL7250986

COc1cc(NC(=O)OCCO)c(O)cc1N

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.45
NPSR1 Q6W5P4 2/20 0.45
ALDH1A1 P00352 1/20 0.45
LMNA P02545 1/20 0.45
TSHR P16473 1/20 0.45
KMT2A Q03164 1/20 0.38
KDM4E B2RXH2 1/20 0.38
DPP4 P27487 1/20 0.36
KCNMA1 Q12791 1/20 0.36
GAA P10253 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
SCHEMBL7250895 0.86 DPP4 (0.48) L3MBTL1NPSR1ALDH1A1LMNATSHR
SCHEMBL7251847 0.84 KDM4E (0.45) L3MBTL1ALDH1A1LMNAKDM4EKCNMA1
SCHEMBL7257252 0.84 L3MBTL1 (0.48) L3MBTL1NPSR1ALDH1A1LMNATSHR
SCHEMBL7256864 0.82 L3MBTL1 (0.46) L3MBTL1NPSR1ALDH1A1LMNATSHR
SCHEMBL7251109 0.81 ALDH1A1 (0.39) L3MBTL1NPSR1ALDH1A1LMNATSHR
SCHEMBL4669168 0.78 ALDH1A1 (0.43) ALDH1A1LMNAKMT2AKDM4E
SCHEMBL4667299 0.78 KDM4E (0.45) L3MBTL1ALDH1A1LMNATSHRKMT2A
SCHEMBL7256416 0.78 HDAC1 (0.43) L3MBTL1ALDH1A1LMNAKDM4EKCNMA1
SCHEMBL4669067 0.77 NPSR1 (0.44) L3MBTL1NPSR1ALDH1A1LMNAKDM4E
SCHEMBL7250103 0.75 SMN1; SMN2 (0.53) L3MBTL1NPSR1ALDH1A1LMNATSHR

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
US-6635091-B2 Oxidation color dye and coupler L'OREAL S. A. (FR) 2003-10-21 US claimed
US-20020178512-A1 Oxidation dyeing composition for keratinous fibres comprising a n-(2-hydrobenzene)-carbamate or a n-(2-hydroxy-benzene)-urea and a pyrazolopyrimine, dyeing methods L'OREAL SA (FR) 2002-12-05 US claimed
US-20010034914-A1 Compositions for the oxidation dyeing of keratinous fibers comprising at least one coupler, and dyeing methods L'OREAL S.A. (FR) 2001-11-01 US claimed
US-6635091-B2 Oxidation color dye and coupler L'OREAL S. A. (FR) 2003-10-21 US disclosed
US-20020178512-A1 Oxidation dyeing composition for keratinous fibres comprising a n-(2-hydrobenzene)-carbamate or a n-(2-hydroxy-benzene)-urea and a pyrazolopyrimine, dyeing methods L'OREAL SA (FR) 2002-12-05 US disclosed
US-20010034914-A1 Compositions for the oxidation dyeing of keratinous fibers comprising at least one coupler, and dyeing methods L'OREAL S.A. (FR) 2001-11-01 US 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 (2 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-20010034914-A1 Compositions for the oxidation dyeing of keratinous fibers comprising at least one coupler, and dyeing methods KRT18, FH, FGB L3MBTL1 4861/4885NPSR1 2547/4885ALDH1A1 352/4885
US-20020178512-A1 Oxidation dyeing composition for keratinous fibres comprising a n-(2-hydrobenzene)-carbamate or a n-(2-hydroxy-benzene)-urea and a pyrazolopyrimine, dyeing methods FH, KRT18, CYB5R3 L3MBTL1 4878/4885NPSR1 2920/4885ALDH1A1 389/4885

“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.