SCHEMBL659208

SCHEMBL659208

COC(=O)C(C(=O)OC)C(CC(=O)c1ccc(Br)cc1)c1ccc(Cl)cc1

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.59
KMT2A Q03164 2/20 0.58
ALDH1A1 P00352 2/20 0.46
MAPT P10636 1/20 0.46
PKM P14618 1/20 0.46
HPGD P15428 1/20 0.46
ALOX12 P18054 1/20 0.46
HTT P42858 1/20 0.46
HSD17B10 Q99714 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
POLB P06746 2/20 0.46
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
GSK3B P49841 1/20 0.41
CNR1 P21554 2/20 0.40

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
SCHEMBL660915 0.88 L3MBTL1 (0.60) L3MBTL1KMT2AALDH1A1MAPTHTT
SCHEMBL657922 0.86 CYP2C9 (0.61) L3MBTL1KMT2AALDH1A1MAPTTDP1
SCHEMBL656174 0.85 KMT2A (0.53) L3MBTL1KMT2AALDH1A1MAPTPKM
SCHEMBL658474 0.84 PDPK1 (0.56) L3MBTL1ALDH1A1MAPTPOLBGSK3B
SCHEMBL657374 0.83 KMT2A (0.72) L3MBTL1KMT2APOLBCYP2C9CYP2C19
SCHEMBL659733 0.83 L3MBTL1 (0.54) L3MBTL1KMT2AMAPTPOLBCYP2C9
SCHEMBL657267 0.81 L3MBTL1 (0.56) L3MBTL1KMT2AALDH1A1MAPTHPGD
SCHEMBL23149235 0.80 L3MBTL1 (0.52) L3MBTL1KMT2AALDH1A1MAPTPOLB
SCHEMBL10448370 0.76 KMT2A (0.66) L3MBTL1KMT2AALDH1A1MAPTHPGD
SCHEMBL7109702 0.76 KMT2A (0.66) L3MBTL1KMT2AALDH1A1MAPTHPGD

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 5 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

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 3302/4885KMT2A 1777/4885ALDH1A1 4784/4885

“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.