SCHEMBL14701710

SCHEMBL14701710

CC(=O)c1cn2c(n1)CCC2

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
WDR5 P61964 7/20 0.50
TP53 P04637 2/20 0.50
HPGD P15428 1/20 0.50
HSD17B10 Q99714 1/20 0.50
NPC1 O15118 7/20 0.44
RAB9A P51151 7/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
ALDH1A1 P00352 4/20 0.44
HTT P42858 3/20 0.42
TSHR P16473 1/20 0.42
LMNA P02545 4/20 0.41
KMT2A Q03164 2/20 0.41
GAA P10253 1/20 0.41
KDM4E B2RXH2 1/20 0.41
GFER P55789 1/20 0.40
MAPT P10636 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC2 Q92769 1/20 0.40
ROCK1 Q13464 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
SCHEMBL8811741 0.95 WDR5 (0.46) WDR5TP53HPGDHSD17B10NPC1
SCHEMBL2325818 0.84 WDR5 (0.49) WDR5TP53HPGDHSD17B10NPC1
SCHEMBL16793684 0.81 WDR5 (0.47) WDR5TP53HPGDHSD17B10NPC1
SCHEMBL870351 0.79 HDAC1 (0.45) WDR5TP53HPGDHSD17B10NPC1
SCHEMBL4090031 0.77 HDAC1 (0.50) WDR5TP53HPGDHSD17B10NPC1
Hydrochloric Acid SCHEMBL871726 0.77 ALDH1A1 (0.45) WDR5TP53HPGDHSD17B10NPC1
SCHEMBL19997213 0.77 TP53 (0.46) WDR5TP53HPGDHSD17B10NPC1
SCHEMBL17321413 0.77 ALDH1A1 (0.42) WDR5TP53HPGDHSD17B10NPC1
SCHEMBL18377471 0.77 HDAC1 (0.50) WDR5TP53HPGDHSD17B10NPC1
SCHEMBL13531866 0.76 HDAC2 (0.46) WDR5TP53HPGDHSD17B10ALDH1A1

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-11725008-B2 Ethanediamine-heterocycle derivatives as inhibitors of protein arginine methyltransferases BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2023-08-15 US disclosed
US-20160318935-A1 BIARYL BRUTON'S TYROSINE KINASE INHIBITORS BIOGEN MA INC. 2016-11-03 US disclosed
US-9284350-B2 IAP BIR domain binding compounds PHARMASCIENCE INC. (CA) 2016-03-15 US disclosed
US-20130040892-A1 IAP BIR DOMAIN BINDING COMPOUNDS PHARMASCIENCE INC. (CA) 2013-02-14 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 (3 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-20160318935-A1 BIARYL BRUTON'S TYROSINE KINASE INHIBITORS ABL1, BTK, LYN WDR5 1483/4885TP53 1146/4885HPGD 4419/4885
US-20130040892-A1 IAP BIR DOMAIN BINDING COMPOUNDS BIRC5, BIRC2, BIRC3 WDR5 764/4885TP53 13/4885HPGD 3739/4885
US-11725008-B2 Ethanediamine-heterocycle derivatives as inhibitors of protein arginine methyltransferases PRMT1, PRMT5, PRMT3 WDR5 504/4885TP53 386/4885HPGD 609/4885

“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.