SCHEMBL6694815

SCHEMBL6694815

CC(=O)Nc1cc([N+](=O)[O-])ccc1CBr

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.56
CYP19A1 P11511 1/20 0.50
KMT2A Q03164 3/20 0.48
MEN1 O00255 1/20 0.48
HTT P42858 3/20 0.46
LMNA P02545 1/20 0.46
GAA P10253 2/20 0.46
CYP1A2 P05177 1/20 0.46
ALDH1A1 P00352 2/20 0.45
DYRK1A Q13627 1/20 0.45
MAPT P10636 1/20 0.45

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
SCHEMBL9445656 0.88 SMN1; SMN2 (0.63) SMN1; SMN2CYP19A1KMT2AHTTGAA
SCHEMBL6696208 0.87 SMN1; SMN2 (0.58) SMN1; SMN2CYP19A1KMT2AMEN1HTT
SCHEMBL22163991 0.82 SMN1; SMN2 (0.56) SMN1; SMN2CYP19A1KMT2AMEN1HTT
SCHEMBL396053 0.80 SMN1; SMN2 (0.57) SMN1; SMN2CYP19A1KMT2AMEN1HTT
SCHEMBL9523590 0.80 SMN1; SMN2 (0.57) SMN1; SMN2CYP19A1KMT2AMEN1HTT
SCHEMBL30168169 0.79 SMN1; SMN2 (0.59) SMN1; SMN2CYP19A1KMT2AHTTGAA
SCHEMBL7122790 0.79 SMN1; SMN2 (0.59) SMN1; SMN2CYP19A1KMT2AHTTGAA
SCHEMBL915213 0.78 MEN1 (0.64) SMN1; SMN2KMT2AMEN1HTTLMNA
SCHEMBL4326710 0.78 SMN1; SMN2 (0.58) SMN1; SMN2CYP19A1KMT2AHTTGAA
SCHEMBL427418 0.78 HTT (0.67) SMN1; SMN2KMT2AMEN1HTTLMNA

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040214798-A1 Nitroaryl phosphoramide compositions and methods for targeting and inhibiting undesirable cell growth or proliferation HU, LONGQIN 2004-10-28 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-20040214798-A1 Nitroaryl phosphoramide compositions and methods for targeting and inhibiting undesirable cell growth or proliferation MKI67, NME2, NTPCR SMN1; SMN2 3095/4885CYP19A1 940/4885KMT2A 1459/4885

“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.