SCHEMBL4220901

SCHEMBL4220901

CC(C)(C)OC(=O)C(=O)N1CCC[C@H]1C(=O)NNC(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.46
MEN1 O00255 1/20 0.44
FKBP1A P62942 3/20 0.41
F2 P00734 2/20 0.41
EPHX2 P34913 1/20 0.39
NPC1 O15118 1/20 0.39
CMA1 P23946 2/20 0.39
LMNA P02545 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
ALDH1A1 P00352 1/20 0.37
PIN1 Q13526 1/20 0.37
ACE P12821 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
SCHEMBL4220908 1.00 KMT2A (0.46) KMT2AMEN1FKBP1AF2EPHX2
SCHEMBL4229009 0.91 KMT2A (0.55) KMT2AMEN1F2EPHX2NPC1
SCHEMBL4229005 0.91 KMT2A (0.55) KMT2AMEN1F2EPHX2NPC1
SCHEMBL13878570 0.87 KMT2A (0.52) KMT2AFKBP1AF2EPHX2NPSR1
SCHEMBL13878822 0.87 KMT2A (0.52) KMT2AFKBP1AF2EPHX2NPSR1
SCHEMBL4229779 0.84 FKBP1A (0.57) KMT2AMEN1FKBP1ACMA1LMNA
SCHEMBL4229783 0.84 FKBP1A (0.57) KMT2AMEN1FKBP1ACMA1LMNA
SCHEMBL19984785 0.80 KMT2A (0.47) KMT2AMEN1FKBP1AF2NPC1
SCHEMBL19984786 0.80 KMT2A (0.47) KMT2AMEN1FKBP1AF2NPC1
SCHEMBL30877536 0.79 KMT2A (0.47) KMT2AMEN1FKBP1AF2NPC1

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
US-20090105091-A1 Modified Amino Acids TECHNISCHE UNIVERSITAT WIEN (AT) 2009-04-23 US disclosed
EP-1826199-A1 Modified amino acids Technische Universität Wien (AT) 2007-08-29 EP disclosed
EP-1826199-A1 Modified amino acids Technische Universität Wien (AT) 2007-08-29 EP 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-20090105091-A1 Modified Amino Acids SLC1A2, NR1H4, OXGR1 KMT2A 1541/4885MEN1 3153/4885FKBP1A 191/4885

“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.