SCHEMBL13558663

SCHEMBL13558663

CC1CC(=O)N(C(C)OO)C1=O

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.34
NPC1 O15118 1/20 0.34
ALDH1A1 P00352 1/20 0.34
GAA P10253 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
MME P08473 1/20 0.33
PIK3CD O00329 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
SCHEMBL9891112 0.83 NPC1 (0.35) MAPTNPC1ALDH1A1GAARAB9A
SCHEMBL12107669 0.79 MME (0.32) MAPTNPC1ALDH1A1GAARAB9A
SCHEMBL13802677 0.78 MAPT (0.41) MAPTNPC1ALDH1A1GAARAB9A
SCHEMBL11912104 0.78 MAPT (0.41) MAPTNPC1ALDH1A1GAARAB9A
SCHEMBL21153268 0.75 MME (0.33) MAPTNPC1ALDH1A1GAARAB9A
SCHEMBL13178384 0.74 MME (0.43) MAPTMMEPIK3CD
SCHEMBL15040816 0.74 MME (0.43) MAPTMMEPIK3CD
SCHEMBL16202441 0.74 MME (0.36) MAPTMMEPIK3CD
SCHEMBL2931296 0.74 MME (0.43) MAPTMMEPIK3CD
SCHEMBL13544349 0.74 KMT2A (0.45) MAPTGAASMN1; SMN2MME

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140155590-A1 Conjugates of Pyrrolo[1,4]Benzodiazepine Dimers As Anticancer Agents SANOFI SA (FR) 2014-06-05 US disclosed
US-20120276124-A1 MAYTANSINOIDS AND THE USE OF SAID MAYTANSINOIDS TO PREPARE CONJUGATES WITH AN ANTIBODY SANOFI (FR) 2012-11-01 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-20120276124-A1 MAYTANSINOIDS AND THE USE OF SAID MAYTANSINOIDS TO PREPARE CONJUGATES WITH AN ANTIBODY C1R, OGFR, ARRB1 MAPT 3150/4885NPC1 1353/4885ALDH1A1 1524/4885
US-20140155590-A1 Conjugates of Pyrrolo[1,4]Benzodiazepine Dimers As Anticancer Agents GABRA4, GABRP, GABRA1 MAPT 1404/4885NPC1 2391/4885ALDH1A1 476/4885

“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.