SCHEMBL5171909

SCHEMBL5171909

NC[C@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.76

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 1/20 0.76
▸ CPA1 P15085 7/20 0.66
▸ CPA3 P15088 3/20 0.66
▸ FOLH1 Q04609 3/20 0.66
▸ CPB1 P15086 1/20 0.66
▸ CPB2 Q96IY4 1/20 0.66
▸ SLC1A3 P43003 1/20 0.65
▸ SLC1A2 P43004 1/20 0.65
▸ SLC1A1 P43005 1/20 0.65
▸ ANPEP P15144 1/20 0.61
▸ ERAP2 Q6P179 1/20 0.61
▸ ALPI P09923 1/20 0.59
▸ PKM P14618 1/20 0.59
▸ PTGS1 P23219 1/20 0.59
▸ XIAP P98170 1/20 0.59
▸ SLC7A5 Q01650 1/20 0.59
▸ MME P08473 1/20 0.56
▸ NAALAD2 Q9Y3Q0 1/20 0.54

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
SCHEMBL4738634 1.00 CYP1A2 (0.76) CYP1A2CPA1CPA3FOLH1CPB1
SCHEMBL558159 1.00 CYP1A2 (0.76) CYP1A2CPA1CPA3FOLH1CPB1
Hydrochloric Acid SCHEMBL23699291 0.98 CYP1A2 (0.73) CYP1A2CPA1CPA3FOLH1CPB1
Ethyl Chloride SCHEMBL1185929 0.91 CYP1A2 (0.63) CYP1A2CPA1CPA3FOLH1CPB1
SCHEMBL6532060 0.89 CYP1A2 (0.60) CYP1A2CPA1CPA3FOLH1CPB1
SCHEMBL4664822 0.87 CYP1A2 (1.00) CYP1A2CPA1CPA3FOLH1CPB1
SCHEMBL19532713 0.86 CYP1A2 (0.61) CYP1A2CPA1CPA3FOLH1CPB1
SCHEMBL6609906 0.86 CYP1A2 (0.61) CYP1A2CPA1CPA3FOLH1CPB1
SCHEMBL7353741 0.86 CYP1A2 (0.61) CYP1A2CPA1CPA3FOLH1CPB1
SCHEMBL22115491 0.85 CYP1A2 (0.95) CYP1A2CPA1CPA3FOLH1CPB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112174842-B Method for preparing (S) -3-amino-2-benzyl propionic acid 苏州山青竹生物医药有限公司 2022-04-26 — — CN claimed
CN-112209850-B Method for preparing (S) -3-amino-2-benzyl methyl propionate 苏州山青竹生物医药有限公司 2022-03-01 — — CN claimed
CN-213886139-U Equipment for producing (S) -3-amino-2-benzyl propionic acid 苏州山青竹生物医药有限公司 2021-08-06 — — CN claimed
CN-213885030-U Purification device of (S) -3-amino-2-benzyl propionic acid 苏州山青竹生物医药有限公司 2021-08-06 — — CN claimed
CN-213443914-U Storage device of (S) -3-amino-2-benzyl propionic acid 苏州山青竹生物医药有限公司 2021-06-15 — — CN claimed
CN-112209850-A Method for preparing (S) -3-amino-2-benzyl methyl propionate 苏州山青竹生物医药有限公司 2021-01-12 — — CN claimed
CN-112174842-A Method for preparing (S) -3-amino-2-benzyl propionic acid 苏州山青竹生物医药有限公司 2021-01-05 — — CN claimed
EP-0446299-A4 METHOD FOR SITE-SPECIFICALLY INCORPORATING UNNATURAL AMINO ACIDS INTO PROTEINS — 1992-05-13 — — EP claimed
EP-0446299-A1 METHOD FOR SITE-SPECIFICALLY INCORPORATING UNNATURAL AMINO ACIDS INTO PROTEINS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1991-09-18 — — EP claimed
WO-1990005785-A1 METHOD FOR SITE-SPECIFICALLY INCORPORATING UNNATURAL AMINO ACIDS INTO PROTEINS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1990-05-31 — — WO claimed
CN-109790114-B Novel chiral ligand, metal chelate, various unnatural amino acids and synthesis method of maraviroc and key intermediate thereof 中国科学院上海药物研究所 2025-03-07 — — CN disclosed
US-20240190930-A1 NEMO COILED COIL MIMICS AND METHODS OF USING SAME UNIV NEW YORK (US) 2024-06-13 — — US disclosed
US-11891422-B2 NEMO coiled coil mimics and methods of using same NEW YORK UNIVERSITY (US) 2024-02-06 — — US disclosed
US-20240034753-A1 THERAPEUTIC PEPTIDES COHBAR, INC. 2024-02-01 — — US disclosed
US-11753445-B2 Therapeutic peptides COHBAR, INC. (US) 2023-09-12 — — US disclosed
EP-0792289-B1 LOW MOLECULAR WEIGHT PEPTIDOMIMETIC GROWTH HORMONE SECRETAGOGUES GENENTECH INC (US) 2000-07-12 — — EP disclosed
US-6034216-A Low molecular weight peptidomimetic growth hormone secretagogues GENENTECH INC. (US) 2000-03-07 — — US disclosed
EP-0446299-A4 METHOD FOR SITE-SPECIFICALLY INCORPORATING UNNATURAL AMINO ACIDS INTO PROTEINS — 1992-05-13 — — EP disclosed
EP-0446299-A1 METHOD FOR SITE-SPECIFICALLY INCORPORATING UNNATURAL AMINO ACIDS INTO PROTEINS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1991-09-18 — — EP disclosed
WO-1990005785-A1 METHOD FOR SITE-SPECIFICALLY INCORPORATING UNNATURAL AMINO ACIDS INTO PROTEINS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1990-05-31 — — 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 (2 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-11891422-B2 NEMO coiled coil mimics and methods of using same COIL, CALCOCO2, NCAPH CYP1A2 2802/4885CPA1 1442/4885CPA3 3159/4885
US-20240190930-A1 NEMO COILED COIL MIMICS AND METHODS OF USING SAME COIL, CALCOCO2, NCAPH CYP1A2 2591/4885CPA1 1357/4885CPA3 3322/4885

“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.

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