SCHEMBL20630862

SCHEMBL20630862

CCOc1cc2nc(N3CCNCC3)nc(N)c2cc1OCC

nearest known ligand 0.75

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.75
APAF1 O14727 1/20 0.75
ALDH1A1 P00352 1/20 0.75
POLB P06746 1/20 0.75
MAPT P10636 1/20 0.75
HPGD P15428 1/20 0.75
UBE2N P61088 1/20 0.75

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
Aminodimethoxyquinazolinylpiperazine SCHEMBL32690190 0.86 KDM4E (1.00) KDM4EAPAF1ALDH1A1POLBMAPT
Aminodimethoxyquinazolinylpiperazine SCHEMBL608966 0.86 KDM4E (1.00) KDM4EAPAF1ALDH1A1POLBMAPT
Aminodimethoxyquinazolinylpiperazine SCHEMBL11079651 0.85 POLB (0.97) KDM4EAPAF1ALDH1A1POLBMAPT
SCHEMBL10625589 0.84 KDM4E (0.53) KDM4EAPAF1ALDH1A1POLBMAPT
SCHEMBL7796182 0.81 KDM4E (0.90) KDM4EAPAF1ALDH1A1POLBMAPT
Hydrochloric Acid SCHEMBL11475168 0.81 POLB (0.88) KDM4EAPAF1ALDH1A1POLBMAPT
SCHEMBL11165343 0.79 KDM4E (0.81) KDM4EAPAF1ALDH1A1POLBMAPT
SCHEMBL2920903 0.78 CHRNB2 (0.46) KDM4EAPAF1ALDH1A1POLBMAPT
SCHEMBL15218289 0.76 KDM4E (0.76) KDM4EAPAF1ALDH1A1POLBMAPT
SCHEMBL13191126 0.76 KDM4E (0.76) KDM4EAPAF1ALDH1A1POLBMAPT

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-20200222405-A1 PEPTIDE AND SMALL MOLECULE AGONISTS OF EPHA AND THEIR USES CASE WESTERN RESERVE UNIVERSITY 2020-07-16 US disclosed
WO-2019010180-A1 PEPTIDE AND SMALL MOLECULE AGONISTS OF EPHA AND THEIR USES CASE WESTERN RESERVE UNIVERSITY (US) 2019-01-10 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-20200222405-A1 PEPTIDE AND SMALL MOLECULE AGONISTS OF EPHA AND THEIR USES EPHA1, EPHA7, EPHA3 KDM4E 4515/4885APAF1 188/4885ALDH1A1 3504/4885

“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.