SCHEMBL5534654

SCHEMBL5534654

COC(=O)c1cc(-c2ccc(N(C)C)cc2)ccc1N

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.53
ALDH1A1 P00352 3/20 0.53
HSD17B10 Q99714 3/20 0.53
GAA P10253 2/20 0.53
MAPT P10636 2/20 0.53
HPGD P15428 2/20 0.53
TSHR P16473 2/20 0.53
ALOX15 P16050 1/20 0.53
CFTR P13569 1/20 0.47
GABRG2 P18507 2/20 0.46
GABRB3 P28472 2/20 0.46
GABRA3 P34903 2/20 0.46
GABRA2 P47869 2/20 0.46
GABRA1 P14867 1/20 0.46
GFER P55789 1/20 0.46
KMT2A Q03164 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
HDAC1 Q13547 2/20 0.45
HDAC6 Q9UBN7 2/20 0.44
GLA P06280 1/20 0.44

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
SCHEMBL1129609 0.87 ALDH1A1 (0.58) KDM4EALDH1A1HSD17B10GAAMAPT
SCHEMBL7529190 0.87 KDM4E (0.66) KDM4EALDH1A1HSD17B10GAAMAPT
Hydrochloric Acid SCHEMBL296819 0.86 ALDH1A1 (0.57) KDM4EALDH1A1HSD17B10GAAMAPT
SCHEMBL421466 0.83 IKBKB (0.65) KDM4EALDH1A1HSD17B10GAAMAPT
SCHEMBL1015993 0.81 KDM4E (0.55) KDM4EALDH1A1HSD17B10GAAMAPT
SCHEMBL4264458 0.81 ABL1 (0.61) KDM4EALDH1A1HSD17B10GAAMAPT
SCHEMBL29481401 0.81 KDM4E (0.55) KDM4EALDH1A1HSD17B10GAAMAPT
SCHEMBL11758709 0.81 KDM4E (0.72) KDM4EALDH1A1HSD17B10GAAMAPT
SCHEMBL29543806 0.80 KDM4E (0.54) KDM4EALDH1A1HSD17B10GAAMAPT
SCHEMBL12686151 0.79 GABRG2 (0.50) KDM4EALDH1A1HSD17B10GAAMAPT

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-20070254889-A1 Compounds and methods useful for rescuing cells from beta-amyloid toxicity and treatment of Alzheimer's disease THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA 2007-11-01 US disclosed
US-20050271584-A1 Biphenyls and fluorenes as imaging agents in alzheimer's disease THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2005-12-08 US disclosed
EP-1553985-A2 BIPHENYLS AND FLUORENES AS IMAGING AGENTS IN ALZHEIMER'S DISEASE The Trustees of The University of Pennsylvania (US) 2005-07-20 EP disclosed
WO-2004032975-A2 BIPHENYLS AND FLUORENES AS IMAGING AGENTS IN ALZHEIMER'S DISEASE THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 2004-04-22 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 (2 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-20070254889-A1 Compounds and methods useful for rescuing cells from beta-amyloid toxicity and treatment of Alzheimer's disease APP, BACE1, IAPP KDM4E 1627/4885ALDH1A1 1209/4885HSD17B10 1585/4885
US-20050271584-A1 Biphenyls and fluorenes as imaging agents in alzheimer's disease APP, BACE2, BACE1 KDM4E 3436/4885ALDH1A1 1533/4885HSD17B10 1755/4885

“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.