SCHEMBL2670566

SCHEMBL2670566

CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCCNC(=O)OC(C)(C)C

nearest known ligand 0.68

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CAPN1 P07384 1/20 0.68
CAPN2 P17655 1/20 0.68
CTSK P43235 14/20 0.67
CTSS P25774 6/20 0.65
CTSL P07711 2/20 0.65
CTSB P07858 1/20 0.65
CA5A P35218 1/20 0.60
MEN1 O00255 1/20 0.59
RECQL P46063 1/20 0.59
KMT2A Q03164 1/20 0.59
SYK P43405 1/20 0.59

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
SCHEMBL10430509 0.96 CAPN1 (0.66) CAPN1CAPN2CTSKCTSSCTSL
SCHEMBL21981385 0.90 CAPN1 (0.59) CAPN1CAPN2CTSKCTSSCTSL
SCHEMBL24130347 0.90 CAPN1 (0.62) CAPN1CAPN2CTSKCTSSCTSL
SCHEMBL21981287 0.90 CTSK (0.58) CAPN1CAPN2CTSKCTSSCTSL
SCHEMBL20669109 0.90 CTSK (0.58) CAPN1CAPN2CTSKCTSSCTSL
SCHEMBL9115066 0.89 CAPN1 (0.80) CAPN1CAPN2CTSKCTSSCTSL
SCHEMBL30902797 0.88 MAPT (0.62) CTSSCTSL
SCHEMBL12148814 0.88 MAPT (0.62)
SCHEMBL21981423 0.87 CAPN1 (0.58) CAPN1CAPN2CTSKCTSLCTSB
SCHEMBL21981425 0.87 CAPN1 (0.58) CAPN1CAPN2CTSKCTSLCTSB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9169289-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) 2015-10-27 US disclosed
US-20140243274-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 STRONGBONE AB (SE) 2014-08-28 US disclosed
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 (2 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 CAPN1 1948/4885CAPN2 1886/4885CTSK 52/4885
US-20140243274-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, CALCRL, ARG1 CAPN1 2260/4885CAPN2 2212/4885CTSK 191/4885

“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.