SCHEMBL30644147

SCHEMBL30644147

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

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TOP1 P11387 2/20 0.45
HRAS P01112 1/20 0.45
ESR1 P03372 1/20 0.45
ESR2 Q92731 1/20 0.45
MAPT P10636 4/20 0.44
POLB P06746 2/20 0.44
KDM4E B2RXH2 1/20 0.44
HIF1A Q16665 1/20 0.44
AR P10275 1/20 0.39
KMT2A Q03164 7/20 0.37
MEN1 O00255 5/20 0.37
ALDH1A1 P00352 3/20 0.37
CTSB P07858 2/20 0.36
HPSE Q9Y251 1/20 0.36
LMNA P02545 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
NPSR1 Q6W5P4 1/20 0.35
NAMPT P43490 1/20 0.34

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
SCHEMBL30644155 0.90 HRAS (0.47) TOP1HRASESR1ESR2MAPT
SCHEMBL6257041 0.90 HRAS (0.47) TOP1HRASESR1ESR2MAPT
SCHEMBL30644202 0.87 HRAS (0.45) TOP1HRASESR1ESR2MAPT
SCHEMBL30644206 0.86 HRAS (0.45) TOP1HRASESR1ESR2MAPT
SCHEMBL27279001 0.84 HRAS (0.47) TOP1HRASESR1ESR2MAPT
SCHEMBL27272956 0.84 HRAS (0.47) TOP1HRASESR1ESR2MAPT
SCHEMBL27276235 0.84 HRAS (0.47) TOP1HRASESR1ESR2MAPT
SCHEMBL27282452 0.84 HRAS (0.47) TOP1HRASESR1ESR2MAPT
SCHEMBL27275434 0.84 HRAS (0.47) TOP1HRASESR1ESR2MAPT
SCHEMBL26374814 0.83 HRAS (0.47) TOP1HRASESR1ESR2MAPT

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 3 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

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 TOP1 322/4885HRAS 830/4885ESR1 1271/4885

“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.