SCHEMBL196696

SCHEMBL196696

CC(C)C(C)[C@H](N)C(=O)O

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 2/20 0.68
SLC1A3 P43003 3/20 0.44
SLC1A2 P43004 3/20 0.44
SLC1A1 P43005 2/20 0.44
TP53 P04637 1/20 0.40
USP2 O75604 1/20 0.36
SLCO1B1 Q9Y6L6 1/20 0.36
GABRP O00591 4/20 0.35
GABRD O14764 4/20 0.35
GABRA1 P14867 4/20 0.35
GABRB1 P18505 4/20 0.35
GABRG2 P18507 4/20 0.35
GABRB3 P28472 4/20 0.35
GABRA5 P31644 4/20 0.35
GABRA3 P34903 4/20 0.35
GABRA2 P47869 4/20 0.35
GABRB2 P47870 4/20 0.35
GABRA4 P48169 4/20 0.35
GABRE P78334 4/20 0.35
GABRA6 Q16445 4/20 0.35

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
SCHEMBL197140 1.00 SLC7A5 (0.68) SLC7A5SLC1A3SLC1A2SLC1A1TP53
SCHEMBL3081722 1.00 SLC7A5 (0.68) SLC7A5SLC1A3SLC1A2SLC1A1TP53
SCHEMBL4588481 1.00 SLC7A5 (0.68) SLC7A5SLC1A3SLC1A2SLC1A1TP53
SCHEMBL5966382 1.00 SLC7A5 (0.68) SLC7A5SLC1A3SLC1A2SLC1A1TP53
SCHEMBL18927234 0.92 SLC7A5 (0.65) SLC7A5SLC1A3SLC1A2SLC1A1TP53
Valine SCHEMBL5065202 0.85
SCHEMBL13502414 0.82 SLC7A5 (0.60) SLC7A5SLC1A3SLC1A2SLC1A1TP53
Valine SCHEMBL1813972 0.81 SLC7A5 (1.00) SLC7A5SLC1A3SLC1A2SLC1A1TP53
Valine SCHEMBL43678 0.81
Valine SCHEMBL8516 0.81

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119592528-A L-amino acid ligase and application thereof in catalytic synthesis of L-valine dipeptide and derivatives thereof 上海合全药物研发有限公司 2025-03-11 CN claimed
CN-117881394-A Pharmaceutical composition and oral dosage form of ketamine derivative 凯瑞康宁生物工程(武汉)有限公司 2024-04-12 CN claimed
CN-111836798-B Prodrugs of ketamine, compositions and uses thereof 凯瑞康宁生物工程(武汉)有限公司 2022-04-15 CN claimed
CN-112135812-A Ketamine derivatives and pharmaceutical compositions thereof 凯瑞康宁生物工程(武汉)有限公司 2020-12-25 CN claimed
US-20250320233-A1 ARGINASE INHIBITOR AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME DAEWOONG PHARMACEUTICAL CO LTD (KR) 2025-10-16 US disclosed
EP-4538278-A1 ARGINASE INHIBITOR AND PHARMACEUTICAL COMPOSITION COMPRISING SAME Daewoong Pharmaceutical Co., Ltd. (KR) 2025-04-16 EP disclosed
US-20250099424-A1 Nitrile-Containing Antiviral Compounds PFIZER INC. (US) 2025-03-27 US disclosed
US-20250084088-A1 ANTIVIRAL COMPOUNDS AND METHODS OF MAKING AND USING THE SAME GILEAD SCIENCES, INC. 2025-03-13 US disclosed
CN-119592528-A L-amino acid ligase and application thereof in catalytic synthesis of L-valine dipeptide and derivatives thereof 上海合全药物研发有限公司 2025-03-11 CN disclosed
WO-2025049493-A1 ANTIVIRAL COMPOUNDS AND METHODS OF MAKING AND USING THE SAME GILEAD SCIENCES, INC. (US) 2025-03-06 WO disclosed
EP-4516301-A2 NITRILE-CONTAINING COMPOUNDS FOR USE AS MEDICAMENTS Pfizer Inc. (US) 2025-03-05 EP disclosed
CN-119213001-A Arginase inhibitors and pharmaceutical compositions comprising same 株式会社大熊制药 2024-12-27 CN disclosed
EP-1578910-A2 NITRILASES DIVERSA CORPORATION (US) 2005-09-28 EP disclosed
EP-1576108-A2 NITRILASES, NUCLEIC ACIDS ENCODING THEM AND METHODS FOR MAKING AND USING THEM DIVERSA CORPORATION (US) 2005-09-21 EP disclosed
US-20040014195-A1 Nitrilases, nucleic acids encoding them and methods for making and using them DIVERSA CORPORATION (US) 2004-01-22 US disclosed
US-20040002147-A1 Nitrilases DIVERSA CORPORATION 2004-01-01 US disclosed
WO-2003097810-A2 NITRILASES, NUCLEIC ACIDS ENCODING THEM AND METHODS FOR MAKING AND USING THEM DIVERSA CORPORATION (US) 2003-11-27 WO disclosed
US-20030124698-A1 Which stereoselectively hydrolyze nitrites or cyanohydrins into acids and ammonia DIVERSA CORPORATION 2003-07-03 US disclosed
WO-2003000840-A2 NITRILASES DIVERSA CORPORATION (US) 2003-01-03 WO disclosed
US-5696230-A ACYCLIC OLIGOPEPTIDE HAVING CONSTRAINED BACKBONE CONFORMATION AND SPASMOGENIC, PLATELET AGGREGATORY, NEUTROPHIL POLARIZATION AND/OR NEUTROPHIL ENZYME RELEASE ACTIVITY THE BOARD OF REGENTS OF THE UNIVERSITY OF NEBRASKA (US) 1997-12-09 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 (6 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-20040014195-A1 Nitrilases, nucleic acids encoding them and methods for making and using them RNGTT, NSUN2, NSUN3 SLC7A5 1798/4885SLC1A3 1001/4885SLC1A2 1013/4885
US-20040002147-A1 Nitrilases RNGTT, DNTT, NOP2 SLC7A5 1746/4885SLC1A3 1217/4885SLC1A2 999/4885
US-20250320233-A1 ARGINASE INHIBITOR AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME ARG1, ARG2, PRMT1 SLC7A5 1030/4885SLC1A3 1134/4885SLC1A2 1462/4885
US-20030124698-A1 Which stereoselectively hydrolyze nitrites or cyanohydrins into acids and ammonia NIT2, DNPH1, ASNS SLC7A5 1527/4885SLC1A3 1115/4885SLC1A2 1261/4885
US-20250099424-A1 Nitrile-Containing Antiviral Compounds ACE2, NOS2, EIF2AK2 SLC7A5 3787/4885SLC1A3 4168/4885SLC1A2 3950/4885
US-20250084088-A1 ANTIVIRAL COMPOUNDS AND METHODS OF MAKING AND USING THE SAME EIF2AK2, MAVS, ZC3HAV1 SLC7A5 3029/4885SLC1A3 4329/4885SLC1A2 4657/4885

“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.