SCHEMBL6664909

SCHEMBL6664909

N=C(N)NCCCC(NC(=O)C(Cc1ccccc1)NC(=O)C(Cc1ccccc1)NC(=O)CN1CCN(CC(=O)O)CCN(CC(=O)O)CCN(CC(=O)O)CC1)C(=O)CCl

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 5/20 0.53
QRFPR Q96P65 3/20 0.48
ALDH1A1 P00352 1/20 0.48
PSMB8 P28062 1/20 0.46
NPY4R P50391 4/20 0.45
NPY5R Q15761 4/20 0.45
NPY1R P25929 3/20 0.45
NPY2R P49146 1/20 0.45
EPHA2 P29317 2/20 0.44
CCKBR P32239 1/20 0.43
NMUR2 Q9GZQ4 1/20 0.42
NMUR1 Q9HB89 1/20 0.42
CTSG P08311 1/20 0.42
CMA1 P23946 1/20 0.42

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
SCHEMBL6046826 0.84 NPY4R (0.61) NPY4RNPY5RNPY1RNPY2RCTSG
SCHEMBL6046817 0.84 NPY4R (0.61) NPY4RNPY5RNPY1RNPY2RCTSG
SCHEMBL6552216 0.84 NPY4R (0.61) NPY4RNPY5RNPY1RNPY2RCTSG
SCHEMBL29299827 0.84 FOLH1 (0.62) FOLH1NPY4RNPY5RNPY1RNPY2R
SCHEMBL29300547 0.84 FOLH1 (0.62) FOLH1NPY4RNPY5RNPY1RNPY2R
SCHEMBL29300546 0.84 FOLH1 (0.62) FOLH1QRFPRNPY4RNPY5RNPY1R
SCHEMBL6046837 0.84 NPY4R (0.48) NPY4RNPY5RNPY1RNPY2RCTSG
SCHEMBL29300471 0.83 FOLH1 (0.65) FOLH1NPY4RNPY5RNPY1RNPY2R
SCHEMBL6805280 0.82 NPY4R (0.54) NPY4RNPY5RNPY1RNPY2RCTSG
SCHEMBL24363268 0.81 FOLH1 (0.49) FOLH1QRFPRNPY4RNPY5RNPY1R

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
US-20040072755-A1 TF antagonist STENNICKE HENNING RALF (DK) 2004-04-15 US disclosed
WO-2004007557-A2 TF ANTAGONIST NOVO NORDISK A/S (DK) 2004-01-22 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-20040072755-A1 TF antagonist TFPI, TFPI2, F3 FOLH1 1366/4885QRFPR 476/4885ALDH1A1 4849/4885

“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.