SCHEMBL657267

SCHEMBL657267

CCOC(=O)C(C(=O)OCC)C(CC(=O)c1ccc(Cl)cc1)c1ccc(Cl)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.56
POLB P06746 2/20 0.52
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
KMT2A Q03164 3/20 0.48
NPC1 O15118 2/20 0.48
MEN1 O00255 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.46
ALDH1A1 P00352 2/20 0.43
MAPT P10636 2/20 0.43
LMNA P02545 1/20 0.43
HPGD P15428 1/20 0.43
TSHR P16473 1/20 0.43
HTT P42858 1/20 0.43
GSK3B P49841 2/20 0.42
RAB9A P51151 1/20 0.42
EPHX2 P34913 1/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 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
SCHEMBL656131 0.93 PDPK1 (0.52) L3MBTL1POLBCYP2C9CYP2C19KMT2A
SCHEMBL656693 0.93 KMT2A (0.55) L3MBTL1POLBCYP2C9CYP2C19KMT2A
SCHEMBL657479 0.88 PDPK1 (0.56) L3MBTL1POLBCYP2C9CYP2C19KMT2A
SCHEMBL657931 0.86 MAPT (0.48) L3MBTL1POLBCYP2C9CYP2C19KMT2A
SCHEMBL657922 0.82 CYP2C9 (0.61) L3MBTL1POLBCYP2C9CYP2C19KMT2A
SCHEMBL7109210 0.82 KMT2A (0.67) L3MBTL1POLBCYP2C9CYP2C19KMT2A
SCHEMBL660915 0.82 L3MBTL1 (0.60) L3MBTL1POLBCYP2C9CYP2C19KMT2A
SCHEMBL28802831 0.81 L3MBTL1 (0.54) L3MBTL1POLBCYP2C9CYP2C19KMT2A
SCHEMBL657876 0.81 CYP2C9 (0.56) L3MBTL1POLBCYP2C9CYP2C19KMT2A
SCHEMBL659208 0.81 L3MBTL1 (0.59) L3MBTL1POLBCYP2C9CYP2C19KMT2A

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 L3MBTL1 3302/4885POLB 4008/4885CYP2C9 4696/4885

“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.