SCHEMBL515914

SCHEMBL515914

CC(Nc1ccc([N+](=O)[O-])cc1)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.54
CA1 P00915 1/20 0.54
MMP2 P08253 1/20 0.54
MMP9 P14780 1/20 0.54
MMP8 P22894 1/20 0.54
MMP14 P50281 1/20 0.54
MEN1 O00255 6/20 0.53
KMT2A Q03164 6/20 0.53
HPGD P15428 1/20 0.53
ALOX12 P18054 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
GAA P10253 2/20 0.53
ALDH1A1 P00352 3/20 0.52
RECQL P46063 2/20 0.52
HSD17B10 Q99714 1/20 0.52
HTT P42858 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
NPC1 O15118 3/20 0.49
RAB9A P51151 2/20 0.49
POLB P06746 2/20 0.49

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
SCHEMBL515915 1.00 CA12 (0.54) CA12CA1MMP2MMP9MMP8
SCHEMBL8373371 1.00 CA12 (0.54) CA12CA1MMP2MMP9MMP8
Water SCHEMBL4754936 0.98 CA12 (0.53) CA12CA1MMP2MMP9MMP8
Water SCHEMBL4754935 0.98 CA12 (0.53) CA12CA1MMP2MMP9MMP8
Hydrochloric Acid SCHEMBL4754929 0.98 CA12 (0.53) CA12CA1MMP2MMP9MMP8
Glycine SCHEMBL8137571 0.91 MEN1 (0.47) CA12CA1MMP2MMP9MMP8
SCHEMBL11906704 0.84 ALDH1A1 (0.44) CA12CA1MMP2MMP9MMP8
Benzoic Acid SCHEMBL11907514 0.84 KMT2A (0.49) CA12CA1MMP2MMP9MMP8
Hydrochloric Acid SCHEMBL5967288 0.83 CA12 (0.51) CA12CA1MMP2MMP9MMP8
SCHEMBL6254462 0.83 MMP9 (0.58) CA12CA1MMP2MMP9MMP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109554437-A A kind of dual wavelength microbial biochemical reaction dynamic interpretation detection method 湖南长沙天地人生物科技有限公司 2019-04-02 CN claimed
CN-108779150-A The Preparation Method And Their Intermediate of Ac-D-2Nal-D-4Cpa-D-3Pal-Ser-4Aph(Hor)-D-4Aph(Cbm)-Leu-Lys(iPr)-Pro-D-Ala-NH2 费森尤斯卡比依普莎姆责任有限公司 2018-11-09 CN claimed
CN-106866786-A L p-nitrophenyl alanimamides dipeptidase derivants and its preparation method and application 西南大学 2017-06-20 CN claimed
CN-103149351-A Synthesis and application of envelope antigen universal for pyrethriods pesticide UNIV JIANGNAN 2013-06-12 CN claimed
US-5565328-A COLORIMETRIC ANALYSIS WITH FLUOROMETRIC READER USING SUITABLE FLUOROPHORE DADE INTERNATIONAL INC. (US) 1996-10-15 US claimed
EP-4743578-A2 THERAPY FOR ALPHA-1 ANTITRYPSIN DEFICIENCY Precigen, Inc. (US) 2026-05-20 EP disclosed
US-12226476-B2 Helper epitope peptide and application thereof CHINA PHARMACEUTICAL UNIVERSITY (CN) 2025-02-18 US disclosed
CN-113396218-B Engineered transaminase polypeptides 科德克希思公司 2025-02-18 CN disclosed
WO-2025014986-A2 THERAPY FOR ALPHA-1 ANTITRYPSIN DEFICIENCY PRECIGEN, INC. (US) 2025-01-16 WO disclosed
EP-3146977-B1 TFPI INHIBITORS AND METHODS OF USE TAKEDA PHARMACEUTICALS CO (JP) 2024-05-08 EP disclosed
WO-2024077134-A1 PRAME IMMUNOGENIC PEPTIDES, BINDING PROTEINS RECOGNIZING PRAME IMMUNOGENIC PEPTIDES, AND USES THEREOF TSCAN THERAPEUTICS, INC. (US) 2024-04-11 WO disclosed
CN-114181935-B Self-assembled DNA tetrahedron and peptide vaccine delivery system 中国药科大学 2023-12-22 CN disclosed
EP-0416033-B1 MACROCYCLIC CHELATES AND METHODS OF USE THEREOF US COMMERCE (US) 1996-03-06 EP disclosed
US-5428154-A Medical diagnosis, radioactive labeling THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1995-06-27 US disclosed
WO-1995015335-A2 PRETARGETING METHODS AND COMPOUNDS NEORX CORPORATION (US) 1995-06-08 WO disclosed
CN-1051914-A The peptide class MERRELL DOW PHARMA 1991-06-05 CN disclosed
EP-0416033-A4 MACROCYCLIC CHELATES AND METHODS OF USE THEREOF US COMMERCE (US) 1991-04-17 EP disclosed
EP-0416033-A1 MACROCYCLIC CHELATES AND METHODS OF USE THEREOF. US COMMERCE (US) 1991-03-13 EP disclosed
US-4923985-A Process for synthesizing macrocyclic chelates THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH & HUMAN SERVICES (US) 1990-05-08 US disclosed
WO-1989011475-A1 MACROCYCLIC CHELATES AND METHODS OF USE THEREOF THE UNITED STATES OF AMERICA, AS REPRESENTED BY TH (US) 1989-11-30 WO disclosed