SCHEMBL538403

SCHEMBL538403

COC(=O)c1ccc(Nc2cc(Cl)ccc2Cl)cc1N=C=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 1/20 0.44
MEN1 O00255 9/20 0.42
KMT2A Q03164 9/20 0.42
HPGD P15428 4/20 0.42
ALDH1A1 P00352 3/20 0.42
LMNA P02545 4/20 0.42
HTT P42858 3/20 0.42
MAPT P10636 2/20 0.42
NPSR1 Q6W5P4 1/20 0.42
USP2 O75604 1/20 0.41
PABPC1 P11940 1/20 0.41
AKR1C3 P42330 2/20 0.40
AKR1C2 P52895 2/20 0.40
POLB P06746 2/20 0.40
SMN1; SMN2 Q16637 3/20 0.39
TSHR P16473 1/20 0.39
HSD17B10 Q99714 1/20 0.39
EGFR P00533 1/20 0.39
ALK Q9UM73 1/20 0.39
GRIK1 P39086 1/20 0.38

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
SCHEMBL9263946 0.83 ABL1 (0.57) ABL1MEN1KMT2AHPGDALDH1A1
SCHEMBL538402 0.77 MEN1 (0.45) ABL1MEN1KMT2AHPGDALDH1A1
SCHEMBL31160876 0.76 ABL1 (0.51) ABL1MEN1KMT2AHPGDALDH1A1
SCHEMBL31160873 0.76 ABL1 (0.51) ABL1MEN1KMT2AHPGDALDH1A1
SCHEMBL10835246 0.71 AKR1C3 (0.53) ABL1MEN1KMT2AHPGDALDH1A1
SCHEMBL4248903 0.70 KDM4E (0.56) MEN1KMT2AHPGDALDH1A1LMNA
SCHEMBL10833792 0.70 AKR1C3 (0.67) ABL1MEN1KMT2AHPGDLMNA
SCHEMBL4611559 0.70 ALDH1A1 (0.56) ABL1MEN1KMT2AHPGDALDH1A1
SCHEMBL7403837 0.70 MAPT (0.67) ABL1MEN1KMT2AHPGDALDH1A1
SCHEMBL19113951 0.69 GAA (0.58) ABL1MEN1KMT2AHPGDALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8940806-B2 Polymerizable compositions BASF SE (DE) 2015-01-27 US disclosed
US-20120041093-A1 POLYMERIZABLE COMPOSITIONS BASF SE (DE) 2012-02-16 US disclosed
EP-2414324-A1 POLYMERIZABLE COMPOSITIONS BASF SE (DE) 2012-02-08 EP disclosed
WO-2010112410-A1 POLYMERIZABLE COMPOSITIONS BASF SE (DE) 2010-10-07 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-20120041093-A1 POLYMERIZABLE COMPOSITIONS H1-10, CBR1, NR1H2 ABL1 1896/4885MEN1 2343/4885KMT2A 675/4885

“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.