SCHEMBL15754331

SCHEMBL15754331

NCCCCC([C]=O)NC(=O)C(CCCCN)NC(=O)C(Cc1ccccc1)NC(=O)C(N)CCCCN

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 1/20 0.57
OPRK1 P41145 2/20 0.49
CTSC P53634 1/20 0.46
GNPAT O15228 1/20 0.46
CALCRL Q16602 2/20 0.46
NPY1R P25929 1/20 0.44
NPY2R P49146 1/20 0.44
NPY4R P50391 1/20 0.44
LTA4H P09960 1/20 0.44
ERAP2 Q6P179 1/20 0.44
LNPEP Q9UIQ6 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
SCHEMBL15754334 1.00 MMP2 (0.57) MMP2OPRK1CTSCGNPATCALCRL
SCHEMBL9450568 0.93 CTSC (0.54) MMP2OPRK1CTSCERAP2LNPEP
SCHEMBL27584126 0.88 GHSR (0.53) MMP2OPRK1GNPAT
SCHEMBL27584132 0.88 GHSR (0.53) MMP2OPRK1GNPAT
SCHEMBL31408938 0.88 MMP2 (0.62) MMP2OPRK1GNPATCALCRLNPY1R
SCHEMBL34464901 0.88 MMP2 (0.62) MMP2OPRK1GNPATCALCRLNPY1R
SCHEMBL9132107 0.87 CTSC (0.60) MMP2OPRK1CTSCLTA4HERAP2
SCHEMBL2196618 0.87 CTSC (0.60) MMP2OPRK1CTSCLTA4HERAP2
SCHEMBL6380974 0.87 MMP2 (0.62) MMP2CTSCLTA4HERAP2LNPEP
SCHEMBL10633263 0.87 CTSC (0.60) MMP2OPRK1CTSCLTA4HERAP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220175872-A1 THERMOGENIC COMPOSITIONS AND METHODS OHIO STATE INNOVATION FOUNDATION 2022-06-09 US claimed
US-10098967-B2 Self-assembly of therapeutic agent-peptide nanostructures OHIO STATE INNOVATION FOUNDATION (US) 2018-10-16 US claimed
US-20180185502-A1 IMMOBILIZATION OF BIOMOLECULES BY SELF-ASSEMBLED NANOSTRUCTURES OHIO STATE INNOVATION FOUNDATION 2018-07-05 US claimed
WO-2017172881-A1 THERMOGENIC COMPOSITIONS AND METHODS OHIO STATE INNOVATION FOUNDATION (US) 2017-10-05 WO claimed
WO-2016210141-A1 IMMOBILIZATION OF BIOMOLECULES BY SELF-ASSEMBLED NANOSTRUCTURES OHIO STATE INNOVATION FOUNDATION (US) 2016-12-29 WO claimed
US-20140155577-A1 SELF-ASSEMBLY OF THERAPEUTIC AGENT-PEPTIDE NANOSTRUCTURES OHIO STATE INNOVATION FOUNDATION (US) 2014-06-05 US claimed
US-20220175872-A1 THERMOGENIC COMPOSITIONS AND METHODS OHIO STATE INNOVATION FOUNDATION 2022-06-09 US disclosed
US-20190083574-A1 THERMOGENIC COMPOSITIONS AND METHODS OHIO STATE INNOVATION FOUNDATION (US) 2019-03-21 US disclosed
US-10098967-B2 Self-assembly of therapeutic agent-peptide nanostructures OHIO STATE INNOVATION FOUNDATION (US) 2018-10-16 US disclosed
US-20180185502-A1 IMMOBILIZATION OF BIOMOLECULES BY SELF-ASSEMBLED NANOSTRUCTURES OHIO STATE INNOVATION FOUNDATION 2018-07-05 US disclosed
WO-2017172881-A1 THERMOGENIC COMPOSITIONS AND METHODS OHIO STATE INNOVATION FOUNDATION (US) 2017-10-05 WO disclosed
WO-2016210141-A1 IMMOBILIZATION OF BIOMOLECULES BY SELF-ASSEMBLED NANOSTRUCTURES OHIO STATE INNOVATION FOUNDATION (US) 2016-12-29 WO disclosed
US-20140155577-A1 SELF-ASSEMBLY OF THERAPEUTIC AGENT-PEPTIDE NANOSTRUCTURES OHIO STATE INNOVATION FOUNDATION (US) 2014-06-05 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 (5 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-20180185502-A1 IMMOBILIZATION OF BIOMOLECULES BY SELF-ASSEMBLED NANOSTRUCTURES CA1, CPN1, CA7 MMP2 45/4885OPRK1 4602/4885CTSC 138/4885
US-20220175872-A1 THERMOGENIC COMPOSITIONS AND METHODS LRBA, IAPP, FABP4 MMP2 370/4885OPRK1 612/4885CTSC 216/4885
US-20140155577-A1 SELF-ASSEMBLY OF THERAPEUTIC AGENT-PEPTIDE NANOSTRUCTURES IAPP, TAP1, LNPEP MMP2 1018/4885OPRK1 2682/4885CTSC 374/4885
US-10098967-B2 Self-assembly of therapeutic agent-peptide nanostructures IAPP, NPPA, TAP1 MMP2 1614/4885OPRK1 3129/4885CTSC 508/4885
US-20190083574-A1 THERMOGENIC COMPOSITIONS AND METHODS LRBA, IAPP, FABP4 MMP2 370/4885OPRK1 612/4885CTSC 216/4885

“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.