SCHEMBL3326907

SCHEMBL3326907

CC(C)(C)N(C(=O)O)C(N)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 1/20 0.44
KDM4E B2RXH2 2/20 0.41
ATM Q13315 2/20 0.41
ALOX5 P09917 1/20 0.41
ADRA2A P08913 1/20 0.38
ADRA2C P18825 1/20 0.38
LMNA P02545 1/20 0.38
HIF1A Q16665 1/20 0.38
CYP2D6 P10635 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
SRC P12931 1/20 0.38
ALDH1A1 P00352 1/20 0.37
MAPT P10636 1/20 0.37
KMT2A Q03164 1/20 0.37
DPP4 P27487 2/20 0.37
F2 P00734 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
SCHEMBL7324351 0.84 ANPEP (0.45) ALDH1A1KMT2A
SCHEMBL16991744 0.81 DPP4 (0.42) AOC3KDM4EATMALOX5ADRA2A
SCHEMBL16991770 0.81 DPP4 (0.42) AOC3KDM4EATMALOX5ADRA2A
SCHEMBL14910544 0.81 DPP4 (0.42) AOC3KDM4EATMALOX5ADRA2A
SCHEMBL14910547 0.81 DPP4 (0.42) AOC3KDM4EATMALOX5ADRA2A
SCHEMBL28340791 0.78 ATM (0.41) AOC3KDM4EATMALOX5LMNA
SCHEMBL14909537 0.77 SLC6A2 (0.42) AOC3KDM4EATMALOX5L3MBTL1
SCHEMBL1231239 0.77 SLC6A2 (0.42) AOC3KDM4EATMALOX5L3MBTL1
SCHEMBL9716115 0.77 SLC6A2 (0.42) AOC3KDM4EATMALOX5L3MBTL1
SCHEMBL17076397 0.76 ATM (0.40) AOC3KDM4EATMALOX5LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100121052-A1 Novel compounds for treating proliferative diseases JAIN RAMA 2010-05-13 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-20100121052-A1 Novel compounds for treating proliferative diseases PDK1, PDK2, PDK3 AOC3 4809/4885KDM4E 1195/4885ATM 338/4885

“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.