SCHEMBL26643141

SCHEMBL26643141

Cn1cc(NC(=O)c2cc([N+](=O)[O-])cn2C)cc1C(=O)NCCCCC(=N)N

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRAS P01112 14/20 0.59
ESR1 P03372 13/20 0.59
ESR2 Q92731 13/20 0.59
TOP1 P11387 2/20 0.59
KDM4E B2RXH2 1/20 0.58
POLB P06746 1/20 0.58
MAPT P10636 1/20 0.58
HIF1A Q16665 1/20 0.58
HDAC1 Q13547 3/20 0.40
HDAC2 Q92769 3/20 0.40
HDAC8 Q9BY41 3/20 0.40
ITGB3 P05106 1/20 0.37
ITGA2B P08514 1/20 0.37
HDAC3 O15379 1/20 0.36
HDAC4 P56524 1/20 0.36
HDAC7 Q8WUI4 1/20 0.36
HDAC10 Q969S8 1/20 0.36
HDAC11 Q96DB2 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
HDAC9 Q9UKV0 1/20 0.36

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
SCHEMBL26643280 0.99 HRAS (0.58) HRASESR1ESR2TOP1KDM4E
Hydrochloric Acid SCHEMBL10690247 0.92 KDM4E (0.69) HRASESR1ESR2TOP1KDM4E
Hydrochloric Acid SCHEMBL10693519 0.92 KDM4E (0.69) HRASESR1ESR2TOP1KDM4E
Hydrochloric Acid SCHEMBL6178110 0.87 KDM4E (0.56) HRASESR1ESR2TOP1KDM4E
SCHEMBL26643200 0.86 HRAS (0.53) HRASESR1ESR2TOP1KDM4E
SCHEMBL26643161 0.85 HRAS (0.49) HRASESR1ESR2TOP1KDM4E
SCHEMBL26374814 0.85 HRAS (0.47) HRASESR1ESR2TOP1KDM4E
SCHEMBL7501738 0.85 HRAS (0.59) HRASESR1ESR2TOP1KDM4E
SCHEMBL26643233 0.85 HRAS (0.56) HRASESR1ESR2TOP1KDM4E
SCHEMBL26643427 0.85 HRAS (0.48) HRASESR1ESR2TOP1KDM4E

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-20250313546-A1 NUCLEIC ACID BINDERS UNIVERSITY OF STRATHCLYDE (GB) 2025-10-09 US disclosed
EP-4522588-A1 NUCLEIC ACID BINDERS University of Strathclyde (GB) 2025-03-19 EP disclosed
CN-119585239-A Nucleic acid binding agents 斯特拉斯克莱德大学 2025-03-07 CN disclosed
WO-2023218194-A1 NUCLEIC ACID BINDERS UNIVERSITY OF STRATHCLYDE (GB) 2023-11-16 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-20250313546-A1 NUCLEIC ACID BINDERS ZFR, NSUN3, POLI HRAS 830/4885ESR1 1271/4885ESR2 2567/4885

“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.