SCHEMBL4508484

SCHEMBL4508484

CC(C)(N)NC(=O)OCc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.57
KMT2A Q03164 1/20 0.57
CA12 O43570 2/20 0.54
CA1 P00915 2/20 0.54
CA2 P00918 2/20 0.54
CA9 Q16790 2/20 0.54
SMN1; SMN2 Q16637 3/20 0.54
ALDH1A1 P00352 2/20 0.53
NPC1 O15118 1/20 0.53
RAB9A P51151 1/20 0.53
LMNA P02545 2/20 0.51
CTSS P25774 1/20 0.51
POLB P06746 1/20 0.49
HTT P42858 1/20 0.49
SYK P43405 1/20 0.48

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
SCHEMBL7359155 0.87 MEN1 (0.55) MEN1KMT2ACA12CA1CA2
SCHEMBL4442846 0.86 KMT2A (0.60) MEN1KMT2ACA12CA1CA2
SCHEMBL6933219 0.86 MEN1 (0.57) MEN1KMT2ACA12CA1CA2
SCHEMBL10885861 0.86 MEN1 (0.53) MEN1KMT2ACA12CA1CA2
SCHEMBL20382395 0.85 KMT2A (0.62) MEN1KMT2ACA12CA1CA2
SCHEMBL6538869 0.84 MEN1 (0.63) MEN1KMT2ACA12CA1CA2
SCHEMBL3560316 0.84 MEN1 (0.55) MEN1KMT2ACA12CA1CA2
SCHEMBL2268248 0.84 MEN1 (0.55) MEN1KMT2ACA12CA1CA2
SCHEMBL16544833 0.83 KMT2A (0.57) MEN1KMT2ACA12CA1CA2
SCHEMBL10349980 0.83 ALDH1A1 (0.58) MEN1KMT2ACA12CA1CA2

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-20090247519-A1 AMINO-ETHYL-AMINO-ARYL (AEAA) COMPOUNDS AND THEIR USE CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2009-10-01 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 (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-20090247519-A1 AMINO-ETHYL-AMINO-ARYL (AEAA) COMPOUNDS AND THEIR USE PKD2, PKD1, AADAT MEN1 4237/4885KMT2A 230/4885CA12 4214/4885

“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.