SCHEMBL14974133

SCHEMBL14974133

O=C(O)NCCCCNOC(=O)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 4/20 0.47
KMT2A Q03164 2/20 0.47
ALDH1A1 P00352 1/20 0.47
MAPT P10636 1/20 0.47
HDAC3 O15379 3/20 0.45
HDAC4 P56524 3/20 0.45
HDAC1 Q13547 3/20 0.45
HDAC7 Q8WUI4 3/20 0.45
HDAC2 Q92769 3/20 0.45
HDAC10 Q969S8 3/20 0.45
HDAC11 Q96DB2 3/20 0.45
HDAC8 Q9BY41 3/20 0.45
HDAC6 Q9UBN7 3/20 0.45
HDAC9 Q9UKV0 3/20 0.45
HDAC5 Q9UQL6 3/20 0.45
NAAA Q02083 1/20 0.45
TDP1 Q9NUW8 3/20 0.44
TSHR P16473 1/20 0.44
SLC6A2 P23975 1/20 0.43
SLC6A3 Q01959 1/20 0.43

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
SCHEMBL10904247 0.90 KMT2A (0.53) POLBKMT2AALDH1A1MAPTHDAC3
Hydrochloric Acid SCHEMBL10905007 0.88 KMT2A (0.52) POLBKMT2AALDH1A1MAPTHDAC3
Hydrochloric Acid SCHEMBL10904248 0.88 KMT2A (0.52) POLBKMT2AALDH1A1MAPTHDAC3
SCHEMBL8519008 0.83 NAAA (0.57) POLBKMT2AALDH1A1MAPTHDAC3
SCHEMBL8375337 0.83 KMT2A (0.50) POLBKMT2AALDH1A1MAPTTDP1
SCHEMBL11503257 0.82 NAAA (0.59) POLBKMT2AALDH1A1MAPTHDAC3
SCHEMBL18196617 0.82 HDAC3 (0.54) POLBKMT2AALDH1A1MAPTHDAC3
SCHEMBL14981917 0.82 NAAA (0.59) POLBKMT2AALDH1A1MAPTHDAC3
SCHEMBL14981922 0.82 NAAA (0.59) POLBKMT2AALDH1A1MAPTHDAC3
SCHEMBL18196734 0.82 NAAA (0.59) POLBKMT2AALDH1A1MAPTHDAC3

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-8735622-B2 Histone demethylase inhibitors and methods for using the same THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE (US) 2014-05-27 US disclosed
US-20130137720-A1 HISTONE DEMETHYLASE INHIBITORS AND METHODS FOR USING THE SAME The Regents of the University of Colorado, a body corporated (US) 2013-05-30 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-20130137720-A1 HISTONE DEMETHYLASE INHIBITORS AND METHODS FOR USING THE SAME KDM1A, KDM3A, KDM7A POLB 1850/4885KMT2A 25/4885ALDH1A1 837/4885

“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.