SCHEMBL6568024

SCHEMBL6568024

COC(=O)c1cc(NC(=O)N(C)CCc2ccc(OC)c(OC)c2)ccc1OC(c1ccccc1)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.48
ALDH1A1 P00352 1/20 0.48
POLB P06746 1/20 0.46
NPY5R Q15761 1/20 0.44
KMT2A Q03164 2/20 0.44
ROCK2 O75116 1/20 0.43
ROCK1 Q13464 1/20 0.43
MEN1 O00255 1/20 0.43
BCHE P06276 1/20 0.43
ACHE P22303 1/20 0.43
NPC1 O15118 1/20 0.42

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
SCHEMBL6566999 0.86 CASR (0.41) NPY5RKMT2AROCK2ROCK1MEN1
SCHEMBL6565988 0.85 KDM4E (0.48) KDM4EALDH1A1POLBKMT2AMEN1
SCHEMBL6566982 0.84 MTOR (0.47) KDM4EALDH1A1NPY5RKMT2AMEN1
SCHEMBL6564606 0.83 CNR1 (0.58) ALDH1A1POLBKMT2AMEN1
SCHEMBL6564452 0.80 KMT2A (0.56) KDM4EALDH1A1POLBKMT2AMEN1
SCHEMBL6568022 0.79 CASR (0.45) KDM4EALDH1A1KMT2AMEN1
SCHEMBL6564738 0.78 CASR (0.44) KDM4EPOLBKMT2AMEN1
SCHEMBL6568097 0.78 CASR (0.54) KDM4EALDH1A1ROCK2ROCK1
SCHEMBL6566741 0.76 MEN1 (0.52) ALDH1A1POLBKMT2AMEN1NPC1
SCHEMBL6565846 0.76 MEN1 (0.52) ALDH1A1POLBKMT2AMEN1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040259912-A1 Benzine derivatives, process for preparing the same and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-12-23 US disclosed
EP-1437344-A1 BENZENE DERIVATIVES,PROCESS FOR PREPARING THE SAME AND USE THEREOF Takeda Chemical Industries, Ltd. (JP) 2004-07-14 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-20040259912-A1 Benzine derivatives, process for preparing the same and use thereof HRH4, HRH2, HRH1 KDM4E 2962/4885ALDH1A1 907/4885POLB 3499/4885

“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.