SCHEMBL6035213

SCHEMBL6035213

CC(=O)NC(CCC(=O)O)C(=O)NCC(=O)NC(C(=O)NC(CCCNC(=N)N)C(=O)NC(CCCNC(=N)N)C(=O)NC(C)C(=O)NC(CC(C)C)C(=O)NC(CC(=O)O)C(N)=O)C(C)C

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TFPI P10646 4/20 0.59
RXFP1 Q9HBX9 2/20 0.54
BACE1 P56817 2/20 0.51
BACE2 Q9Y5Z0 2/20 0.51
NPY5R Q15761 3/20 0.49
NPY1R P25929 2/20 0.49
NPY4R P50391 2/20 0.49
PTPN1 P18031 1/20 0.46
IL23R Q5VWK5 2/20 0.46
YWHAZ P63104 1/20 0.44

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
SCHEMBL15985693 0.92 TFPI (0.55) TFPIRXFP1BACE1BACE2NPY5R
SCHEMBL31157763 0.88 NPY4R (0.53) TFPIRXFP1BACE1BACE2NPY5R
SCHEMBL31437196 0.86 TFPI (0.48) TFPIRXFP1NPY5RNPY1RNPY4R
SCHEMBL31637662 0.85 TFPI (0.60) TFPIRXFP1
SCHEMBL31211755 0.85 BACE1 (0.50) TFPIRXFP1BACE1BACE2
SCHEMBL31211801 0.85 BACE1 (0.50) TFPIRXFP1BACE1BACE2
SCHEMBL31211765 0.85 BACE1 (0.50) TFPIRXFP1BACE1BACE2
SCHEMBL31211785 0.85 BACE1 (0.50) TFPIRXFP1BACE1BACE2
SCHEMBL31467753 0.83 NPY4R (0.48) TFPIBACE1BACE2NPY5RNPY1R
SCHEMBL30974563 0.83 TFPI (0.51) TFPIRXFP1BACE1

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-8748370-B2 Peptide derivatives for treatment, prevention or alleviation of a condition associated with bone loss or low bone density or to inhibit osteoclast differentiation and stimulation STRONGBONE AB (SE) 2014-06-10 US disclosed
US-20120108515-A1 NOVEL PEPTIDE DERIVATIVES FOR TREATMENT, PREVENTION OR ALLEVIATION OF A CONDITION ASSOCIATED WITH BONE LOSS OR LOW BONE DENSITY OR TO INHIBIT OSTEOCLAST DIFFERENTIATION AND STIMULATION NEOBIOTICS AB (SE) 2012-05-03 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-20120108515-A1 NOVEL PEPTIDE DERIVATIVES FOR TREATMENT, PREVENTION OR ALLEVIATION OF A CONDITION ASSOCIATED WITH BONE LOSS OR LOW BONE DENSITY OR TO INHIBIT OSTEOCLAST DIFFERENTIATION AND STIMULATION BMP2, SOST, BMP1 TFPI 896/4885RXFP1 43/4885BACE1 722/4885

“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.