SCHEMBL5863084

SCHEMBL5863084

O=C(Nc1ccc(N2CCOCC2)cc1)c1ccc(Nc2ccc(Oc3ccccc3)cc2)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.69
KMT2A Q03164 2/20 0.69
HDAC8 Q9BY41 1/20 0.64
HDAC6 Q9UBN7 1/20 0.64
MAPT P10636 8/20 0.62
NPC1 O15118 3/20 0.62
RAB9A P51151 3/20 0.62
PKM P14618 3/20 0.62
TP53 P04637 2/20 0.62
ATM Q13315 1/20 0.62
MAPK1 P28482 1/20 0.62
LMNA P02545 2/20 0.60
HPGDS O60760 2/20 0.59
PGR P06401 1/20 0.59
ALDH1A1 P00352 4/20 0.59
SMN1; SMN2 Q16637 3/20 0.58
EPHX1 P07099 1/20 0.58
DGAT1 O75907 1/20 0.57
NTRK1 P04629 1/20 0.57
NFKB1 P19838 1/20 0.56

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
SCHEMBL8770431 0.88 HDAC8 (0.81) MEN1KMT2AHDAC8HDAC6MAPT
SCHEMBL21295393 0.85 MAPT (0.64) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL2565238 0.85 HDAC8 (0.76) MEN1KMT2AHDAC8HDAC6MAPT
SCHEMBL4252909 0.85 HDAC8 (0.76) MEN1KMT2AHDAC8HDAC6MAPT
SCHEMBL5863233 0.83 HDAC8 (0.62) MEN1KMT2AHDAC8HDAC6MAPT
SCHEMBL13610006 0.82 HPGDS (0.85) MEN1KMT2AHDAC8HDAC6MAPT
SCHEMBL21254538 0.82 MAPT (0.74) MEN1KMT2AHDAC8HDAC6MAPT
SCHEMBL14982100 0.81 MEN1 (0.58) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL1663346 0.81 HDAC8 (0.70) MEN1KMT2AHDAC8HDAC6MAPT
SCHEMBL6014834 0.80 RAB9A (0.67) MEN1KMT2AMAPTNPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7125997-B2 Differential tumor cytotoxicity compounds and compositions IRM LLC (BM) 2006-10-24 US claimed
US-7125997-B2 Differential tumor cytotoxicity compounds and compositions IRM LLC (BM) 2006-10-24 US disclosed
US-20040132786-A1 Differential tumor cytotoxicity compounds and compositions IRM LLC, A DELAWARE LIMITED LIABILITY COMPANY (BM) 2004-07-08 US 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-20040132786-A1 Differential tumor cytotoxicity compounds and compositions MIF, FOXM1, MYADM MEN1 1175/4885KMT2A 4187/4885HDAC8 2867/4885

“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.