SCHEMBL6803131

SCHEMBL6803131

CCCc1ccc(CC(=O)NC(Cc2ccc([N+](=O)[O-])cc2)C(=O)NCc2ccccc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.60
KMT2A Q03164 2/20 0.60
CTSL P07711 3/20 0.54
CTSB P07858 1/20 0.54
CTSS P25774 1/20 0.54
PTPN1 P18031 2/20 0.50
PTPN2 P17706 1/20 0.50
FCER2 P06734 3/20 0.48
MMP1 P03956 2/20 0.48
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
KLKB1 P03952 2/20 0.47
KLK1 P06870 1/20 0.47
HTT P42858 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
CHRNA1 P02708 1/20 0.46
CHRNG P07510 1/20 0.46
CHRNB1 P11230 1/20 0.46
CHRND Q07001 1/20 0.46

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
SCHEMBL6803124 1.00 MEN1 (0.60) MEN1KMT2ACTSLCTSBCTSS
SCHEMBL7134683 0.91 CTSS (0.52) MEN1KMT2ACTSLCTSBCTSS
SCHEMBL6807927 0.85 CTSL (0.58) CTSLCTSBCTSSFCER2MMP1
SCHEMBL6807932 0.85 CTSL (0.58) CTSLCTSBCTSSFCER2MMP1
SCHEMBL6828040 0.83 MEN1 (0.70) MEN1KMT2ACTSLCTSBCTSS
SCHEMBL6828028 0.83 MEN1 (0.70) MEN1KMT2ACTSLCTSBCTSS
SCHEMBL6801389 0.81 CTSL (0.53) CTSLCTSBCTSSFCER2MMP1
SCHEMBL6801392 0.81 CTSL (0.53) CTSLCTSBCTSSFCER2MMP1
SCHEMBL6803382 0.78 CTSS (0.63) CTSLCTSBCTSSPSMB1PSMB5
SCHEMBL6803119 0.78 CTSS (0.63) CTSLCTSBCTSSPSMB1PSMB5

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-20040167183-A1 Phenethylamino sulfamic acids THE PROCTER & GAMBLE COMPANY 2004-08-26 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-20040167183-A1 Phenethylamino sulfamic acids PTPRM, PTPRS, PTPRE MEN1 4379/4885KMT2A 2262/4885CTSL 2677/4885

“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.