SCHEMBL19487377

SCHEMBL19487377

CC(C)(C)OC(=O)/N=C(\NCCC=O)NC(=O)OC(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
TDP1 Q9NUW8 1/20 0.36
MEN1 O00255 1/20 0.35
GAA P10253 1/20 0.35
KMT2A Q03164 1/20 0.35
EPHX1 P07099 1/20 0.34
CA1 P00915 4/20 0.33
CA2 P00918 4/20 0.33
CTSK P43235 3/20 0.33
CA12 O43570 2/20 0.31
CA9 Q16790 2/20 0.31
MALT1 Q9UDY8 1/20 0.30
CYP2D6 P10635 1/20 0.30

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
SCHEMBL17642036 1.00 MAOA (0.38) MAOAMAOBTDP1MEN1GAA
SCHEMBL10150695 0.92 MAOA (0.43) MAOAMAOBTDP1MEN1GAA
SCHEMBL5491014 0.89 MAOA (0.50) MAOAMAOBTDP1MEN1GAA
SCHEMBL19820012 0.87 TDP1 (0.31) MAOAMAOBTDP1MEN1GAA
Hydrochloric Acid SCHEMBL25250069 0.84 MEN1 (0.39) MAOAMAOBTDP1MEN1GAA
SCHEMBL19820104 0.83 CTSS (0.43) MAOAMAOBTDP1CA1CA2
SCHEMBL19820105 0.83 CTSS (0.43) MAOAMAOBTDP1CA1CA2
SCHEMBL15343533 0.83 TDP1 (0.39) MAOAMAOBTDP1MEN1GAA
SCHEMBL18257731 0.83 TDP1 (0.46) MAOAMAOBTDP1MEN1GAA
SCHEMBL12074270 0.83 TDP1 (0.46) MAOAMAOBTDP1MEN1GAA

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
US-10626144-B2 Peptide derivatives and uses thereof NOSOPHARM (FR) 2020-04-21 US disclosed
US-20170298097-A1 Peptide Derivatives and Uses Thereof NOSOPHARM (FR) 2017-10-19 US disclosed
US-20150328207-A1 BENZOQUINOLINE INHIBITORS OF VESICULAR MONOAMINE TRANSPORTER 2 AUSPEX PHARMACEUTICALS, INC. 2015-11-19 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 (3 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-10626144-B2 Peptide derivatives and uses thereof VIP, IAPP, NGLY1 MAOA 4842/4885MAOB 4711/4885TDP1 3978/4885
US-20150328207-A1 BENZOQUINOLINE INHIBITORS OF VESICULAR MONOAMINE TRANSPORTER 2 SLC18A2, SLC6A2, SLC18A1 MAOA 23/4885MAOB 18/4885TDP1 1159/4885
US-20170298097-A1 Peptide Derivatives and Uses Thereof VIP, IAPP, NGLY1 MAOA 4842/4885MAOB 4711/4885TDP1 3978/4885

“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.