SCHEMBL5083101

SCHEMBL5083101

N[C@@H](Cc1cc(Br)cc(Br)c1)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 4/20 0.57
PTGS1 P23219 2/20 0.57
PKM P14618 2/20 0.57
ALPI P09923 1/20 0.57
XIAP P98170 1/20 0.57
HSD17B10 Q99714 5/20 0.53
USP2 O75604 4/20 0.53
ALOX15 P16050 3/20 0.53
ADORA3 P0DMS8 3/20 0.53
KDM4E B2RXH2 2/20 0.53
RECQL P46063 2/20 0.53
HIF1A Q16665 2/20 0.53
TDP1 Q9NUW8 2/20 0.53
PTGS2 P35354 2/20 0.53
EGFR P00533 1/20 0.53
LCK P06239 1/20 0.53
FYN P06241 1/20 0.53
HTR2A P28223 1/20 0.53
SIRT5 Q9NXA8 1/20 0.49
THRB P10828 4/20 0.47

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
SCHEMBL7448572 1.00 SLC7A5 (0.57) SLC7A5PTGS1PKMALPIXIAP
SCHEMBL31537504 0.88 SLC7A5 (0.49) SLC7A5PTGS1PKMALPIXIAP
SCHEMBL22944380 0.88 SLC7A5 (0.49) SLC7A5PTGS1PKMALPIXIAP
SCHEMBL10676768 0.84 SLC7A5 (0.49) SLC7A5PTGS1PKMALPIXIAP
SCHEMBL5325945 0.84 SLC7A5 (0.49) SLC7A5PTGS1PKMALPIXIAP
SCHEMBL14935980 0.82 SLC7A5 (0.65) SLC7A5PTGS1PKMALPIXIAP
SCHEMBL29567654 0.82 SLC7A5 (0.65) SLC7A5PTGS1PKMALPIXIAP
SCHEMBL44026 0.82 SLC7A5 (0.65) SLC7A5PTGS1PKMALPIXIAP
SCHEMBL44027 0.82 SLC7A5 (0.65) SLC7A5PTGS1PKMALPIXIAP
SCHEMBL29400795 0.82 SLC7A5 (0.65) SLC7A5PTGS1PKMALPIXIAP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240382556-A1 METHODS AND COMPOSITIONS FOR THE TREATMENT OF ALCOHOL DEPENDENCE DUKE UNIVERSITY 2024-11-21 US claimed
US-20220031798-A1 METHODS AND COMPOSITIONS FOR THE TREATMENT OF OPIOID DEPENDENCE AND FOR THE TREATMENT OF PAIN DUKE UNIVERSITY (US) 2022-02-03 US claimed
WO-2015127558-A1 METHODS AND USES FOR INDUCING OR FACILITATING MICTURITION IN A PATIENT IN NEED THEREOF UNIVERSITé LAVAL (CA) 2015-09-03 WO claimed
EP-0950046-A1 3,4-DISUBSTITUTED AZETIDIN-2-ONE DERIVATIVES USEFUL AS CYSTEINE PROTEINASE REGULATORS SYNPHAR LABORATORIES INC. (CA) 1999-10-20 EP claimed
WO-1998012176-A1 3,4-DISUBSTITUTED AZETIDIN-2-ONE DERIVATIVES USEFUL AS CYSTEINE PROTEINASE REGULATORS SYNPHAR LABORATORIES INC. (US) 1998-03-26 WO claimed
US-20260083759-A1 Combinations Comprising Psychedelics for the Treatment of Schizophrenia and Other Neuropsychiatric and Neurologic Disorders HADASIT MED RES SERVICE (IL) 2026-03-26 US disclosed
US-12485115-B2 Biased NMDA receptor modulators and uses thereof EDWARD Via COLLEGE OF OSTEOPATHIC MEDICINE (US) 2025-12-02 US disclosed
EP-4583858-A1 COMBINATIONS COMPRISING PSYCHEDELICS FOR THE TREATMENT OF SCHIZOPHRENIA AND OTHER NEUROPSYCHIATRIC AND NEUROLOGIC DISORDERS Hadasit Medical Research Services&Development Ltd. (IL) 2025-07-16 EP disclosed
WO-2025099725-A1 CONJUGATES AND USES THEREOF HADASIT MEDICAL RESEARCH SERVICES AND DEVELOPMENT LTD. (IL) 2025-05-15 WO disclosed
WO-2025079064-A1 INTERLEUKIN-17 PEPTIDOMIMETIC INHIBITORS PEPTICOM LTD. (IL) 2025-04-17 WO disclosed
US-20240382556-A1 METHODS AND COMPOSITIONS FOR THE TREATMENT OF ALCOHOL DEPENDENCE DUKE UNIVERSITY 2024-11-21 US disclosed
WO-2024052895-A1 COMBINATIONS COMPRISING PSYCHEDELICS FOR THE TREATMENT OF SCHIZOPHRENIA AND OTHER NEUROPSYCHIATRIC AND NEUROLOGIC DISORDERS HADASIT MEDICAL RESEARCH SERVICES AND DEVELOPMENT LTD (IL) 2024-03-14 WO disclosed
US-20180142287-A1 Compositions, Methods and Kits for Detection of Genetic Variants for Alzheimer's Disease THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (HK) 2018-05-24 US disclosed
WO-2015127558-A1 METHODS AND USES FOR INDUCING OR FACILITATING MICTURITION IN A PATIENT IN NEED THEREOF UNIVERSITé LAVAL (CA) 2015-09-03 WO disclosed
US-20080096870-A1 Methods and Materials for Treating Mental Illness UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. 2008-04-24 US disclosed
EP-1778211-A1 METHODS AND MATERIALS FOR TREATING MENTAL ILLNESS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2007-05-02 EP disclosed
WO-2006020171-A1 METHODS AND MATERIALS FOR TREATING MENTAL ILLNESS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2006-02-23 WO disclosed
EP-0950046-A1 3,4-DISUBSTITUTED AZETIDIN-2-ONE DERIVATIVES USEFUL AS CYSTEINE PROTEINASE REGULATORS SYNPHAR LABORATORIES INC. (CA) 1999-10-20 EP disclosed
WO-1998012176-A1 3,4-DISUBSTITUTED AZETIDIN-2-ONE DERIVATIVES USEFUL AS CYSTEINE PROTEINASE REGULATORS SYNPHAR LABORATORIES INC. (US) 1998-03-26 WO disclosed
US-4766121-A NOT AFFECTING THE HEART SMITH KLINE & FRENCH LABORATORIES LTD. (GB) 1988-08-23 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 (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-20260083759-A1 Combinations Comprising Psychedelics for the Treatment of Schizophrenia and Other Neuropsychiatric and Neurologic Disorders BDNF, NTRK2, GRIN2A SLC7A5 3582/4885PTGS1 3978/4885PKM 3100/4885
US-20240382556-A1 METHODS AND COMPOSITIONS FOR THE TREATMENT OF ALCOHOL DEPENDENCE GRIN3A, GRIN1, GRIN2A SLC7A5 1802/4885PTGS1 706/4885PKM 1484/4885
US-20220031798-A1 METHODS AND COMPOSITIONS FOR THE TREATMENT OF OPIOID DEPENDENCE AND FOR THE TREATMENT OF PAIN OPRL1, OPRK1, OPRM1 SLC7A5 1778/4885PTGS1 839/4885PKM 1745/4885
US-12485115-B2 Biased NMDA receptor modulators and uses thereof GRIN1, GRIN2A, GRIN3A SLC7A5 3119/4885PTGS1 2919/4885PKM 908/4885

“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.