SCHEMBL2394737

SCHEMBL2394737

CC(C)(C)OC(=O)NC1(C(=N)NO)CC1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
MAPK1 P28482 1/20 0.36
GHSR Q92847 1/20 0.33
CTSL P07711 1/20 0.33
APLNR P35414 1/20 0.32
NFKB1 P19838 1/20 0.31
NFKB2 Q00653 1/20 0.31
RELA Q04206 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
GAA P10253 1/20 0.31
ALDH1A1 P00352 1/20 0.31
BTK Q06187 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA7 P43166 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
SCHEMBL12310396 0.85 MEN1 (0.35) KMT2AMEN1MAPK1GHSRCTSL
SCHEMBL142425 0.82 MEN1 (0.37) KMT2AMEN1MAPK1GHSRCTSL
Hydrochloric Acid SCHEMBL2392949 0.81 SPHK1 (0.37) KMT2AMEN1MAPK1GHSRCTSL
SCHEMBL142219 0.78 MEN1 (0.39) KMT2AMEN1MAPK1GHSRCTSL
SCHEMBL144836 0.78 MEN1 (0.39) KMT2AMEN1MAPK1GHSRCTSL
SCHEMBL24462189 0.77 MEN1 (0.37) KMT2AMEN1MAPK1APLNRBTK
SCHEMBL12802333 0.77 SPHK1 (0.35) KMT2AMEN1MAPK1GHSRCTSL
SCHEMBL2392486 0.77 KMT2A (0.38) KMT2AMEN1MAPK1GHSRCTSL
SCHEMBL20624889 0.77 KMT2A (0.41) KMT2AMEN1MAPK1GHSRCTSL
SCHEMBL4963475 0.77 MEN1 (0.38) KMT2AMEN1MAPK1GHSRCTSL

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
EP-2225238-B1 DERIVATIVES OF 6,7-DIHYDRO-5H-IMIDAZOÝ1,2- ¨IMIDAZOLE-3- CARBOXYLIC ACID AMIDES BOEHRINGER INGELHEIM INT (DE) 2014-09-03 EP disclosed
US-8552205-B2 Derivatives of 6,7-dihydro-5H-imidazo[1,2-alpha]imidazole-3-carboxylic acid amides BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-10-08 US disclosed
US-20110224188-A1 DERIVATIVES OF 6,7-DIHYDRO-5H-IMIDAZO[1,2-alpha]IMIDAZOLE-3-CARBOXYLIC ACID AMIDES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-09-15 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 (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-20110224188-A1 DERIVATIVES OF 6,7-DIHYDRO-5H-IMIDAZO[1,2-alpha]IMIDAZOLE-3-CARBOXYLIC ACID AMIDES HPGDS, COL14A1, ARG1 KMT2A 2995/4885MEN1 4830/4885MAPK1 1413/4885

“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.