SCHEMBL2587281

SCHEMBL2587281

CC(Cc1ccccc1)C(N)C(=O)O

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC1A3 P43003 4/20 0.65
SLC1A2 P43004 4/20 0.65
SLC1A1 P43005 4/20 0.65
CYP2D6 P10635 2/20 0.62
ALPI P09923 1/20 0.60
PKM P14618 1/20 0.60
PTGS1 P23219 1/20 0.60
XIAP P98170 1/20 0.60
SLC7A5 Q01650 1/20 0.60
SLC6A2 P23975 2/20 0.55
TAAR1 Q96RJ0 2/20 0.55
MAOA P21397 1/20 0.55
SLC6A4 P31645 1/20 0.55
SLC6A3 Q01959 1/20 0.55
SIGMAR1 Q99720 1/20 0.55
CYP2A6 P11509 1/20 0.55
ADORA2A P29274 1/20 0.55
ADORA1 P30542 1/20 0.55
TRPA1 O75762 2/20 0.55
CYP1A2 P05177 2/20 0.53

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
SCHEMBL28554624 1.00 SLC1A3 (0.65) SLC1A3SLC1A2SLC1A1CYP2D6ALPI
SCHEMBL2587284 1.00 SLC1A3 (0.65) SLC1A3SLC1A2SLC1A1CYP2D6ALPI
SCHEMBL15835402 1.00 SLC1A3 (0.65) SLC1A3SLC1A2SLC1A1CYP2D6ALPI
SCHEMBL30963017 1.00 SLC1A3 (0.65) SLC1A3SLC1A2SLC1A1CYP2D6ALPI
SCHEMBL30963023 0.85 SLC1A3 (0.47) SLC1A3SLC1A2SLC1A1CYP2D6ALPI
SCHEMBL23521343 0.83 GRIA2 (0.56) SLC1A3SLC1A2SLC1A1CYP2D6SLC7A5
D-Phenylalanine SCHEMBL1537167 0.83 SLC7A5 (0.69) SLC1A3SLC1A2SLC1A1CYP2D6ALPI
Phenylalanine SCHEMBL528154 0.83 SLC7A5 (0.69) SLC1A3SLC1A2SLC1A1CYP2D6ALPI
D-Phenylalanine SCHEMBL1537464 0.83 SLC7A5 (0.69) SLC1A3SLC1A2SLC1A1CYP2D6ALPI
Phenylalanine SCHEMBL1537266 0.83 SLC7A5 (0.69) SLC1A3SLC1A2SLC1A1CYP2D6ALPI

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 29 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9533023-B2 EIF4E binding peptides AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2017-01-03 US disclosed
EP-2569327-B1 EIF4E BINDING PEPTIDES AGENCY SCIENCE TECH & RES (SG) 2016-05-25 EP disclosed
US-9278993-B2 Cell-targeting nanoparticles and uses thereof AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2016-03-08 US disclosed
US-20160046672-A1 STAPLING eIF4E INTERACTING PEPTIDES AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2016-02-18 US disclosed
US-20160038567-A1 EIF4E BINDING PEPTIDES AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2016-02-11 US disclosed
EP-2976354-A1 STAPLING eIF4E INTERACTING PEPTIDES Agency For Science, Technology And Research (SG) 2016-01-27 EP disclosed
CN-105263950-A Stapling eif4e interacting peptides AGENCY SCIENCE TECH & RES 2016-01-20 CN disclosed
US-9018348-B2 eIF4E binding peptides AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2015-04-28 US disclosed
WO-2014149001-A1 STAPLING eIF4E INTERACTING PEPTIDES AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2014-09-25 WO disclosed
US-20130130989-A1 EIF4E BINDING PEPTIDES AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2013-05-23 US disclosed
EP-1750740-A1 TREATMENT OF MEMBRANE-ASSOCIATED DISEASES AND DISORDERS USING LANTIBIOTIC CONTAINING COMPOSITIONS MOLICHEM MEDICINES, INC. (US) 2007-02-14 EP disclosed
WO-2005115432-A2 TREATMENT OF OCULAR DISEASES AND DISORDERS USING LANTIBIOTIC COMPOSITIONS MOLICHEM MEDICINES, INC. (US) 2005-12-08 WO disclosed
WO-2005107787-A1 TREATMENT OF MEMBRANE-ASSOCIATED DISEASES AND DISORDERS USING LANTIBIOTIC CONTAINING COMPOSITIONS MOLICHEM MEDICINES, INC. (US) 2005-11-17 WO disclosed
US-20050250681-A1 Treatment of ocular diseases and disorders using lantibiotic compositions MOLICHEM MEDICINES, INC. (US) 2005-11-10 US disclosed
US-20050250682-A1 Treatment of membrane-associated diseases and disorders using lantibiotic containing compositions MOLICHEM MEDICINES, INC. (US) 2005-11-10 US disclosed
EP-0973540-B1 ISOLATION AND STRUCTURAL ELUCIDATION OF THE CYTOSTATIC LINEAR AND CYCLO-DEPSIPEPTIDES DOLASTATIN 16, DOLASTATIN 17, AND DOLASTATIN 18 UNIV ARIZONA (US) 2005-11-02 EP disclosed
EP-0973540-A4 ISOLATION AND STRUCTURAL ELUCIDATION OF THE CYTOSTATIC LINEAR AND CYCLO-DEPSIPEPTIDES DOLASTATIN 16, DOLASTATIN 17, AND DOLASTATIN 18 UNIV ARIZONA (US) 2002-05-15 EP disclosed
US-6239104-B1 ISOLATED AND PURIFIED SUBSTANCE WHICH INHIBITS NEOPLASTIC CELL GROWTH DENOMINATED DOLASTATIN 16 ARIZONA BOARD OF REGENTS 2001-05-29 US disclosed
EP-0973540-A1 ISOLATION AND STRUCTURAL ELUCIDATION OF THE CYTOSTATIC LINEAR AND CYCLO-DEPSIPEPTIDES DOLASTATIN 16, DOLASTATIN 17, AND DOLASTATIN 18 ARIZONA BOARD OF REGENTS (US) 2000-01-26 EP disclosed
WO-1998036765-A1 ISOLATION AND STRUCTURAL ELUCIDATION OF THE CYTOSTATIC LINEAR AND CYCLO-DEPSIPEPTIDES DOLASTATIN 16, DOLASTATIN 17, AND DOLASTATIN 18 ARIZONA BOARD OF REGENTS (US) 1998-08-27 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 (3 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-20050250681-A1 Treatment of ocular diseases and disorders using lantibiotic compositions LPXN, EYA3, EYA2 SLC1A3 1058/4885SLC1A2 1434/4885SLC1A1 1647/4885
US-20050250682-A1 Treatment of membrane-associated diseases and disorders using lantibiotic containing compositions PKD2, DDR1, PKD1 SLC1A3 3208/4885SLC1A2 2950/4885SLC1A1 2656/4885
US-20160046672-A1 STAPLING eIF4E INTERACTING PEPTIDES EIF4EBP1, EIF4E, EIF4G2 SLC1A3 2637/4885SLC1A2 3708/4885SLC1A1 3256/4885

“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.