SCHEMBL428267

SCHEMBL428267

NC(CCCc1ccccc1F)C(=O)O

nearest known ligand 0.68

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SLC1A5 Q15758 2/20 0.51
PTPN1 P18031 1/20 0.48
GRIK1 P39086 1/20 0.48
TAAR1 Q96RJ0 1/20 0.47
NOS1 P29475 2/20 0.47
POLB P06746 1/20 0.47
KMT2A Q03164 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
GSR P00390 1/20 0.46
KIF11 P52732 3/20 0.45
ALPI P09923 1/20 0.43
PKM P14618 1/20 0.43
PTGS1 P23219 1/20 0.43
XIAP P98170 1/20 0.43
SLC7A5 Q01650 1/20 0.43

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
SCHEMBL16148360 0.90 SLC1A5 (0.53) SLC1A5PTPN1GRIK1TAAR1NOS1
SCHEMBL16148359 0.90 SLC1A5 (0.53) SLC1A5PTPN1GRIK1TAAR1NOS1
SCHEMBL31691522 0.90 SLC1A5 (0.53) SLC1A5PTPN1GRIK1TAAR1NOS1
SCHEMBL22444963 0.90 SLC1A5 (0.53) SLC1A5PTPN1GRIK1TAAR1NOS1
SCHEMBL16542480 0.88 SLC1A5 (0.45) SLC1A5GRIK1NOS1POLBKMT2A
SCHEMBL18522513 0.87 TAAR1 (0.47) SLC1A5PTPN1GRIK1TAAR1
SCHEMBL27254720 0.83 SLC1A5 (0.48) SLC1A5PTPN1TAAR1KMT2AKIF11
SCHEMBL431530 0.81 DPP9 (0.44) SLC1A5GRIK1NOS1GSR
SCHEMBL16542500 0.81 DPP9 (0.44) SLC1A5GRIK1NOS1GSR
SCHEMBL14381171 0.81 SLC1A5 (0.51) SLC1A5GRIK1TAAR1NOS1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10919844-B2 Antibacterials and/or modulators of biofilm formation and methods of using the same INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2021-02-16 US disclosed
US-20180215704-A1 ANTIBACTERIALS AND/OR MODULATORS OF BIOFILM FORMATION AND METHODS OF USING THE SAME INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2018-08-02 US disclosed
US-20170044097-A1 ANTIBACTERIALS AND/OR MODULATORS OF BIOFILM FORMATION AND METHODS OF USING THE SAME INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION 2017-02-16 US disclosed
US-8883963-B2 Peptidomimetics with glucagon antagonistic and GLP 1 agonistic activities CADILA HEALTHCARE LIMITED (IN) 2014-11-11 US disclosed
EP-2231701-B1 PEPTIDOMIMETICS WITH GLUCAGON ANTAGONISTIC AND GLP-1 AGONISTIC ACTIVITIES CADILA HEALTHCARE LTD (IN) 2012-04-18 EP disclosed
US-20120021972-A1 PEPTIDOMIMETICS WITH GLUCAGON ANTAGONISTIC AND GLP 1 AGONISTIC ACTIVITIES CADILA HEALTHCARE LIMITED (IN) 2012-01-26 US disclosed
EP-2231701-A2 PEPTIDOMIMETICS WITH GLUCAGON ANTAGONISTIC AND GLP-1 AGONISTIC ACTIVITIES Cadila Healthcare Limited (IN) 2010-09-29 EP disclosed
WO-2009125424-A2 PEPTIDOMIMETICS WITH GLUCAGON ANTAGONISTIC AND GLP-1 AGONISTIC ACTIVITIES CADILA HEALTHCARE LIMITED (IN) 2009-10-15 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 (4 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-10919844-B2 Antibacterials and/or modulators of biofilm formation and methods of using the same NRDC, FIBP, BMP2 SLC1A5 3080/4885PTPN1 2564/4885GRIK1 3949/4885
US-20180215704-A1 ANTIBACTERIALS AND/OR MODULATORS OF BIOFILM FORMATION AND METHODS OF USING THE SAME NRDC, FIBP, BMP2 SLC1A5 3080/4885PTPN1 2564/4885GRIK1 3949/4885
US-20170044097-A1 ANTIBACTERIALS AND/OR MODULATORS OF BIOFILM FORMATION AND METHODS OF USING THE SAME NRDC, FIBP, BMP2 SLC1A5 3080/4885PTPN1 2564/4885GRIK1 3949/4885
US-20120021972-A1 PEPTIDOMIMETICS WITH GLUCAGON ANTAGONISTIC AND GLP 1 AGONISTIC ACTIVITIES GLP1R, GPR119, GIPR SLC1A5 1819/4885PTPN1 304/4885GRIK1 368/4885

“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.