Phenylalanine

Phenylalanine

SCHEMBL18953085

N=C(N)NCCC[C@H](N)C(=O)Nc1ccc2ccccc2c1.N[C@@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 3/20 0.43
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
EPHX1 P07099 2/20 0.42
SLC1A3 P43003 1/20 0.41
SLC1A2 P43004 1/20 0.41
SLC1A1 P43005 1/20 0.41
NOS3 P29474 1/20 0.41
NOS1 P29475 1/20 0.41
NOS2 P35228 1/20 0.41
TRHDE Q9UKU6 1/20 0.40
MMP2 P08253 1/20 0.40
NPY4R P50391 3/20 0.40
NPY1R P25929 2/20 0.40
NPY2R P49146 2/20 0.40
NPY5R Q15761 2/20 0.40
HDAC3 O15379 1/20 0.40

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
Dl-Phenylalanine SCHEMBL20580864 1.00 LTA4H (0.43) LTA4HALPIPKMPTGS1XIAP
SCHEMBL2585866 0.91 EPHX1 (0.47) LTA4HEPHX1SLC1A3SLC1A2SLC1A1
SCHEMBL29359776 0.91 EPHX1 (0.47) LTA4HEPHX1SLC1A3SLC1A2SLC1A1
Hydrochloric Acid SCHEMBL4087778 0.90 EPHX1 (0.46) LTA4HEPHX1SLC1A3SLC1A2SLC1A1
Pabetan SCHEMBL29894618 0.87 NPY4R (0.46) EPHX1TRHDENPY4RNPY1RNPY2R
Pabetan SCHEMBL21571465 0.87 NPY4R (0.46) EPHX1TRHDENPY4RNPY1RNPY2R
Pabetan SCHEMBL14928984 0.87 NPY4R (0.46) EPHX1TRHDENPY4RNPY1RNPY2R
Pabetan SCHEMBL4546522 0.87 NPY4R (0.46) EPHX1TRHDENPY4RNPY1RNPY2R
Arginine SCHEMBL29067351 0.85 ALPI (0.46) ALPIPKMPTGS1XIAPSLC7A5
Arginine SCHEMBL29094092 0.84 ALPI (0.45) ALPIPKMPTGS1XIAPSLC7A5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190023694-A1 BROAD SPECTRUM ANTIBACTERIAL ACTIVITY OF NOVEL BISBENZIMIDAZOLES TARGETING TOPOISOMERASE IA AND THE SYNERGISTIC COMPOSITION OF BISBENZIMIDAZOLE WITH EFFLUX PUMP INHIBITORS AGAINST PATHOGENIC BACTERIA TANDON, VIBHA (IN) 2019-01-24 US claimed
WO-2017125944-A1 BROAD SPECTRUM ANTIBACTERIAL ACTIVITY OF NOVEL BISBENZIMIDAZOLES TARGETING TOPOISOMERASE IA AND THE SYNERGISTIC COMPOSITION OF BISBENZIMIDAZOLE WITH EFFLUX PUMP INHIBITORS AGAINST PATHOGENIC BACTERIA JAWAHARLAL NEHRU UNIVERSITY (JNU) (IN) 2017-07-27 WO claimed
US-11951154-B2 Compositions and methods for cell delivery FLAGSHIP PIONEERING INNOVATIONS V, INC. (US) 2024-04-09 US disclosed
US-20230407243-A1 GENETIC PLATFORM TO INVESTIGATE THE FUNCTIONS OF BACTERIAL DRUG EFFLUX PUMPS UNIVERSITY OF GUELPH (CA) 2023-12-21 US disclosed
US-11746116-B2 Antibiotic resistance breakers KING'S COLLEGE LONDON (GB) 2023-09-05 US disclosed
US-20230174978-A1 METHODS AND COMPOSITIONS FOR MODULATING GENE EXPRESSION FLAGSHIP PIONEERING INNOVATIONS V, INC. 2023-06-08 US disclosed
US-20230054672-A1 METHODS AND COMPOSITIONS FOR MODULATING GENE EXPRESSION FLAGSHIP PIONEERING INNOVATIONS V, INC. 2023-02-23 US disclosed
US-20230024896-A1 COMPOSITIONS AND METHODS FOR CELL DELIVERY PIONEERING MEDICINES 08- B, INC. 2023-01-26 US disclosed
US-11382950-B2 Compositions and methods for cell delivery FLAGSHIP PIONEERING INNOVATIONS V, INC. (US) 2022-07-12 US disclosed
US-11312955-B2 Methods and compositions for modulating gene expression FLAGSHIP PIONEERING INNOVATIONS V, INC. (US) 2022-04-26 US disclosed
US-20220023270-A1 ANTIBACTERIAL COMPOUNDS AND USES THEREOF THE CHILDREN'S MEDICAL CENTER CORPORATION (US) 2022-01-27 US disclosed
WO-2018220365-A1 ANTIBIOTIC RESISTANCE BREAKERS KING'S COLLEGE LONDON (GB) 2018-12-06 WO disclosed
EP-3386985-A1 PBD ANTIBACTERIAL AGENTS Kings College London (GB) 2018-10-17 EP disclosed
US-20180179525-A1 METHODS AND COMPOSITIONS FOR MODULATING GENE EXPRESSION FLAGSHIP PIONEERING INNOVATIONS V, INC. 2018-06-28 US disclosed
WO-2018049077-A1 METHODS AND COMPOSITIONS FOR MODULATING GENE EXPRESSION FLAGSHIP PIONEERING, INC. (US) 2018-03-15 WO disclosed
WO-2018049075-A1 METHODS AND COMPOSITIONS FOR MODULATING GENE EXPRESSION FLAGSHIP PIONEERING, INC. (US) 2018-03-15 WO disclosed
WO-2018049079-A1 METHODS AND COMPOSITIONS FOR MODULATING GENE EXPRESSION FLAGSHIP PIONEERING, INC. (US) 2018-03-15 WO disclosed
WO-2018049073-A1 METHODS AND COMPOSITIONS FOR MODULATING GENE EXPRESSION FLAGSHIP PIONEERING, INC. (US) 2018-03-15 WO disclosed
WO-2017125944-A1 BROAD SPECTRUM ANTIBACTERIAL ACTIVITY OF NOVEL BISBENZIMIDAZOLES TARGETING TOPOISOMERASE IA AND THE SYNERGISTIC COMPOSITION OF BISBENZIMIDAZOLE WITH EFFLUX PUMP INHIBITORS AGAINST PATHOGENIC BACTERIA JAWAHARLAL NEHRU UNIVERSITY (JNU) (IN) 2017-07-27 WO disclosed
WO-2017098257-A1 PBD ANTIBACTERIAL AGENTS KING'S COLLEGE LONDON (GB) 2017-06-15 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 (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-11746116-B2 Antibiotic resistance breakers ABCC1, ARL1, AKR1C3 LTA4H 1137/4885ALPI 511/4885PKM 3042/4885
US-20220023270-A1 ANTIBACTERIAL COMPOUNDS AND USES THEREOF CLPP, SPOUT1, MRPL21 LTA4H 1179/4885ALPI 247/4885PKM 2549/4885
US-20190023694-A1 BROAD SPECTRUM ANTIBACTERIAL ACTIVITY OF NOVEL BISBENZIMIDAZOLES TARGETING TOPOISOMERASE IA AND THE SYNERGISTIC COMPOSITION OF BISBENZIMIDAZOLE WITH EFFLUX PUMP INHIBITORS AGAINST PATHOGENIC BACTERIA TOP2B, TOP2A, TOP1 LTA4H 4391/4885ALPI 435/4885PKM 2814/4885

“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.