SCHEMBL658260

SCHEMBL658260

CCOC(=O)C(C(=O)OCC)C(CC(=O)c1cccc(Cl)c1)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.52
MEN1 O00255 5/20 0.52
NPC1 O15118 2/20 0.51
ERCC5 P28715 1/20 0.45
FEN1 P39748 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.43
ELANE P08246 1/20 0.43
GPR139 Q6DWJ6 2/20 0.43
ATM Q13315 1/20 0.43
LMNA P02545 2/20 0.43
TP53 P04637 1/20 0.43
PDPK1 O15530 2/20 0.42
RAB9A P51151 1/20 0.42
MAPT P10636 2/20 0.41
ALDH1A1 P00352 2/20 0.41
TDP2 O95551 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
HPGD P15428 1/20 0.41

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
SCHEMBL7109210 0.87 KMT2A (0.67) KMT2AMEN1NPC1SMN1; SMN2ATM
SCHEMBL656693 0.86 KMT2A (0.55) KMT2AMEN1NPC1SMN1; SMN2PDPK1
SCHEMBL657730 0.84 MEN1 (0.63) KMT2AMEN1ERCC5FEN1GPR139
SCHEMBL656638 0.81 PDPK1 (0.53) KMT2AMEN1NPC1SMN1; SMN2PDPK1
SCHEMBL657479 0.81 PDPK1 (0.56) KMT2AMEN1NPC1PDPK1MAPT
SCHEMBL7107026 0.80 KMT2A (0.61) KMT2AMEN1NPC1SMN1; SMN2ATM
SCHEMBL657931 0.80 MAPT (0.48) KMT2AMEN1NPC1SMN1; SMN2LMNA
SCHEMBL657267 0.79 L3MBTL1 (0.56) KMT2AMEN1NPC1SMN1; SMN2LMNA
SCHEMBL1437086 0.79 KMT2A (0.56) KMT2AMEN1NPC1ERCC5FEN1
SCHEMBL658879 0.78 KMT2A (0.55) KMT2AMEN1NPC1LMNAPDPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2349999-B1 ALLOSTERIC PROTEIN KINASE MODULATORS UNIV SAARLAND (DE) 2016-01-27 EP disclosed
US-8912186-B2 Allosteric protein kinase modulators UNIVERSITAET DES SAARLANDES (DE) 2014-12-16 US disclosed
US-20120046307-A1 ALLOSTERIC PROTEIN KINASE MODULATORS UNIVERSITAET DES SAARLANDES (DE) 2012-02-23 US disclosed
EP-2349999-A1 ALLOSTERIC PROTEIN KINASE MODULATORS Universität des Saarlandes (DE) 2011-08-03 EP disclosed
WO-2010043711-A1 ALLOSTERIC PROTEIN KINASE MODULATORS UNIVERSITAET DES SAARLANDES (DE) 2010-04-22 WO disclosed
EP-2177510-A1 Allosteric protein kinase modulators Universität des Saarlandes (DE) 2010-04-21 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-20120046307-A1 ALLOSTERIC PROTEIN KINASE MODULATORS AURKC, AURKA, AURKB KMT2A 1777/4885MEN1 2058/4885NPC1 2687/4885

“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.