SCHEMBL5162453

SCHEMBL5162453

COc1ccc(-c2c3n(c4cc(OC)c(OC)cc24)CCN(C(C)C)C3=O)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 3/20 0.41
KDM4E B2RXH2 5/20 0.39
HPGD P15428 3/20 0.39
HIF1A Q16665 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.36
ALDH1A1 P00352 3/20 0.36
MAPT P10636 2/20 0.36
HRH3 Q9Y5N1 1/20 0.36
ATM Q13315 1/20 0.34
CTSL P07711 1/20 0.34
CYP19A1 P11511 1/20 0.33
KMT2A Q03164 2/20 0.33
POLB P06746 1/20 0.33
GAA P10253 1/20 0.33
ALOX12 P18054 1/20 0.33
NTSR1 P30989 1/20 0.33
HTT P42858 1/20 0.33
PAX8 Q06710 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
TLR9 Q9NR96 1/20 0.33

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
SCHEMBL5160476 0.85 KDM4E (0.47) PDE4AKDM4EHPGDHIF1AL3MBTL1
SCHEMBL4591386 0.80 PARP1 (0.46) PDE4AKDM4EHPGDHIF1AL3MBTL1
Hydrochloric Acid SCHEMBL4611337 0.75 ABCB1 (0.37) KDM4EHPGDHIF1AL3MBTL1ALDH1A1
SCHEMBL4592228 0.72 PKM (0.40) KDM4EL3MBTL1ALDH1A1POLBTLR9
SCHEMBL4592565 0.72 MTNR1A (0.43) KDM4EHPGDHIF1AL3MBTL1KMT2A
Hydrochloric Acid SCHEMBL4875908 0.71 MTNR1A (0.42) KDM4EHPGDHIF1AL3MBTL1ALDH1A1
SCHEMBL4592013 0.70 CREBBP (0.45) KDM4EHPGDL3MBTL1ALDH1A1MAPT
SCHEMBL4592547 0.70 PKM (0.42) KDM4EALDH1A1KMT2APOLBGAA
SCHEMBL4591110 0.69 PARP1 (0.42) PDE4AKDM4EHPGDHIF1AALDH1A1
SCHEMBL4592544 0.69 KDM4E (0.41) KDM4EHPGDL3MBTL1ALDH1A1MAPT

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-20070248672-A1 Indole and Azaindole Derivatives with Antitumor Action NIKEM RESEARCH S.R.L. (IT) 2007-10-25 US disclosed
EP-1750687-A2 INDOLE AND AZAINDOLE DERIVATIVES WITH ANTITUMOR ACTION NIKEM RESEARCH S.R.L. (IT) 2007-02-14 EP disclosed
WO-2005105213-A2 INDOLE AND AZAINDOLE DERIVATIVES WITH ANTITUMOR ACTION NIKEM RESEARCH S.R.L. (IT) 2005-11-10 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-20070248672-A1 Indole and Azaindole Derivatives with Antitumor Action IDO1, IDO2, INMT PDE4A 3378/4885KDM4E 512/4885HPGD 253/4885

“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.