SCHEMBL26643200

SCHEMBL26643200

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

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HRAS P01112 13/20 0.53
ESR1 P03372 13/20 0.53
ESR2 Q92731 13/20 0.53
TOP1 P11387 2/20 0.53
KDM4E B2RXH2 1/20 0.53
POLB P06746 1/20 0.53
MAPT P10636 1/20 0.53
HIF1A Q16665 1/20 0.53
AR P10275 2/20 0.38
HPSE Q9Y251 1/20 0.37
F10 P00742 1/20 0.35
PLAU P00749 1/20 0.35
PLAT P00750 1/20 0.35

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
Hydrochloric Acid SCHEMBL10693519 0.88 KDM4E (0.69) HRASESR1ESR2TOP1KDM4E
Hydrochloric Acid SCHEMBL10690247 0.88 KDM4E (0.69) HRASESR1ESR2TOP1KDM4E
Hydrochloric Acid SCHEMBL6178110 0.87 KDM4E (0.56) HRASESR1ESR2TOP1KDM4E
SCHEMBL26643141 0.86 HRAS (0.59) HRASESR1ESR2TOP1KDM4E
SCHEMBL26643280 0.86 HRAS (0.58) HRASESR1ESR2TOP1KDM4E
Hydrochloric Acid SCHEMBL7534552 0.83 KDM4E (0.47) HRASESR1ESR2TOP1KDM4E
SCHEMBL30644147 0.82 TOP1 (0.45) HRASESR1ESR2TOP1KDM4E
SCHEMBL27279001 0.82 HRAS (0.47) HRASESR1ESR2TOP1KDM4E
SCHEMBL27276235 0.82 HRAS (0.47) HRASESR1ESR2TOP1KDM4E
SCHEMBL27282452 0.82 HRAS (0.47) 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.