SCHEMBL15096829

SCHEMBL15096829

CC(C)(C)OC(=O)NC=CNC(=O)OC(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPK10 P53779 1/20 0.41
DGAT1 O75907 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
CA7 P43166 2/20 0.39
CTSK P43235 3/20 0.39
MEN1 O00255 1/20 0.38
GAA P10253 1/20 0.38
KMT2A Q03164 1/20 0.38
MIF P14174 1/20 0.38
CA12 O43570 2/20 0.37
CA14 Q9ULX7 2/20 0.37
APLNR P35414 1/20 0.37
NPC1 O15118 1/20 0.37
RECQL P46063 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL12571335 1.00 MAPK10 (0.41) MAPK10DGAT1TDP1CA1CA2
SCHEMBL8294662 0.88 CTSK (0.43) MAPK10DGAT1TDP1CA1CA2
SCHEMBL22433833 0.88 MAPK10 (0.38) MAPK10DGAT1TDP1CA1CA2
SCHEMBL8603435 0.88 CTSK (0.43) MAPK10DGAT1TDP1CA1CA2
SCHEMBL16938665 0.88 MAPK10 (0.38) MAPK10DGAT1TDP1CA1CA2
SCHEMBL8603431 0.88 CTSK (0.43) MAPK10DGAT1TDP1CA1CA2
SCHEMBL28354658 0.88 MAPK10 (0.38) MAPK10DGAT1TDP1CA1CA2
SCHEMBL6488438 0.86 MAPK10 (0.37) MAPK10DGAT1TDP1CA1CA2
SCHEMBL221182 0.86 MAPK10 (0.37) MAPK10DGAT1TDP1CA1CA2
SCHEMBL8035972 0.86 MAPK10 (0.37) MAPK10DGAT1TDP1CA1CA2

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-8969573-B2 Compounds for the inhibition of cellular proliferation PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2015-03-03 US disclosed
US-20130178505-A1 Compounds for the Inhibition of Cellular Proliferation PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2013-07-11 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-20130178505-A1 Compounds for the Inhibition of Cellular Proliferation MKI67, EIF2AK2, CDK2 MAPK10 721/4885DGAT1 1609/4885TDP1 1805/4885

“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.