SCHEMBL6807740

SCHEMBL6807740

CNC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)N(Cc1ccccc1)C(C)=O

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
CRHBP P24387 2/20 0.49
CRHR2 Q13324 2/20 0.49
NPC1 O15118 1/20 0.48
TP53 P04637 1/20 0.48
RAB9A P51151 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
MC4R P32245 1/20 0.47
TMEM97 Q5BJF2 2/20 0.47
SIGMAR1 Q99720 2/20 0.47
MMP2 P08253 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
SCHEMBL6807744 1.00 MEN1 (0.50) MEN1KMT2ACRHBPCRHR2NPC1
SCHEMBL6803449 0.90 MEN1 (0.47) MEN1KMT2ACRHBPCRHR2NPC1
SCHEMBL6803444 0.90 MEN1 (0.47) MEN1KMT2ACRHBPCRHR2NPC1
SCHEMBL6808091 0.88 MEN1 (0.52) MEN1KMT2ACRHBPCRHR2NPC1
SCHEMBL6808095 0.88 MEN1 (0.52) MEN1KMT2ACRHBPCRHR2NPC1
SCHEMBL6827943 0.86 ITGA4 (0.46) MEN1KMT2ACRHBPCRHR2NPC1
SCHEMBL6827938 0.86 ITGA4 (0.46) MEN1KMT2ACRHBPCRHR2NPC1
SCHEMBL6797299 0.79 PTPRB (0.51) MEN1KMT2A
SCHEMBL6797296 0.79 PTPRB (0.51) MEN1KMT2A
SCHEMBL6919388 0.79 MEN1 (0.53) MEN1KMT2ACRHBPCRHR2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004074238-A1 PHENETHYLAMINO SULFAMIC ACIDS THE PROCTER & GAMBLE COMPANY (US) 2004-09-02 WO disclosed
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 2262/4885CRHBP 4056/4885

“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.