SCHEMBL2188394

SCHEMBL2188394

Cc1ccc(NC(=O)CBr)cc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.73
HDAC3 O15379 2/20 0.58
HDAC1 Q13547 2/20 0.58
HDAC2 Q92769 2/20 0.58
HDAC10 Q969S8 2/20 0.58
HDAC11 Q96DB2 2/20 0.58
HDAC8 Q9BY41 2/20 0.58
HDAC6 Q9UBN7 2/20 0.58
HDAC4 P56524 1/20 0.58
HDAC7 Q8WUI4 1/20 0.58
HDAC9 Q9UKV0 1/20 0.58
HDAC5 Q9UQL6 1/20 0.58
TDP1 Q9NUW8 1/20 0.57
ALDH1A1 P00352 1/20 0.56
NCOR2 Q9Y618 1/20 0.56
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
HTT P42858 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54
GAA P10253 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
SCHEMBL15267699 0.89 KMT2A (0.60) POLBHDAC3HDAC1HDAC2HDAC10
SCHEMBL6414674 0.86 POLB (0.71) POLBHDAC3HDAC1HDAC2HDAC10
SCHEMBL8141144 0.85 POLB (1.00) POLBHDAC3HDAC1HDAC2HDAC10
SCHEMBL19962693 0.84 POLB (0.68) POLBHDAC3HDAC1HDAC2HDAC10
SCHEMBL12807727 0.83 GAA (0.61) POLBALDH1A1MEN1KMT2AHTT
SCHEMBL11638641 0.83 SMN1; SMN2 (0.59) POLBTDP1ALDH1A1MEN1KMT2A
SCHEMBL14578751 0.83 POLB (0.85) POLBHDAC3HDAC1HDAC2HDAC10
SCHEMBL23540107 0.81 HDAC3 (0.70) POLBHDAC3HDAC1HDAC2HDAC10
SCHEMBL1039601 0.81 KMT2A (0.76) TDP1ALDH1A1MEN1KMT2AHTT
SCHEMBL2093671 0.81 POLB (0.76) POLBHDAC3HDAC1HDAC2HDAC10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118459362-A N-aryl-2- (2-hydroxybenzyloxy) acetamides, preparation method and application thereof 湖南科技大学 2024-08-09 CN disclosed
CN-114716344-B 2- ((2-acetamidophenyl) amino) acetamido compound and preparation method and application thereof 湖南科技大学 2023-12-22 CN disclosed
CN-117003744-A Five-membered and six-membered compound, intermediate, preparation method, composition and application 厦门市博瑞来医药科技有限公司 2023-11-07 CN disclosed
US-20230333019-A1 TWO-PHOTON FLUORESCENT PROBES FOR SIMULTANEOUSLY DETECTING CALCIUM IONS IN ORGANELLES AND LYSOSOMAL PROTONS KOREA UNIVERSITY RESEARCH AND BUSINESS FOUNDATION (KR) 2023-10-19 US disclosed
CN-114409657-B 4-aryl (methyl) imidazoline quinoxalinone compound and preparation method and application thereof 湖南科技大学 2023-02-24 CN disclosed
CN-110790724-B Selective carbonic anhydrase inhibitor and synthesis method and application thereof 中山大学 2023-01-31 CN disclosed
CN-114716344-A 2- ((2-acetamidophenyl) amino) acetyl arylamine compound and preparation method and application thereof 湖南科技大学 2022-07-08 CN disclosed
CN-114409657-A 4-aryl (methyl) imidazoline quinoxalinone compound and preparation method and application thereof 湖南科技大学 2022-04-29 CN disclosed
CN-110790724-A Selective carbonic anhydrase inhibitor and synthesis method and application thereof 中山大学 2020-02-14 CN disclosed
US-20170121344-A1 THIENOPYRIDINE DERIVATIVES FOR THE TREATMENT AND PREVENTION OF DENGUE VIRUS INFECTIONS SIGA TECHNOLOGIES, INC. (US) 2017-05-04 US disclosed
US-6127544-A 1-SUBSTITUTED-3-UREIDO-INDOLIN-2-ONES WHICH EXHIBIT SELECTIVE ANTAGONISM AGAINST GASTRIN RECEPTORS WITHOUT CAUSING SIDE EFFECTS ATTRIBUTED TO CCK-A RECEPTOR ANTAGONISM; SUCH AS FOR TREATMENT OF PEPTIC ULCERS, GASTRITIS CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2000-10-03 US disclosed
US-6114536-A ANTAGONISM AGAINST GASTRIN RECEPTORS WITHOUT CAUSING SIDE EFFECTS ATTRIBUTED TO CCK-A RECEPTOR ANTAGONISM AND ARE USEFUL FOR THE TREATMENT AND PREVENTION OF DISEASES OF DIGESTIVE ORGANS, SUCH AS PEPTIC ULCER, GASTRITIS CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2000-09-05 US disclosed
WO-2000037473-A1 EPOTHILONE DERIVATIVES AND THEIR USE AS ANTITUMOR AGENTS NOVARTIS AG (CH) 2000-06-29 WO disclosed
US-6031111-A Indolin-2-one derivatives CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2000-02-29 US disclosed
CN-1046268-C Indolin-2-one derivatives CHUGAI PHARMACEUTICAL CO LTD (JP) 1999-11-10 CN disclosed
US-5952511-A EXHIBITS SELECTIVE ANTAGONISM AGAINST GASTRIN RECEPTOR WITHOUT CAUSING SIDE EFFECTS ATTRIBUTED TO GASTRIN RECEPTOR ANTAGONISM AND USEFUL FOR TREATING PEPTIC ULCER, GASTRITIS, REFLUX ESOPHAGITIS AND ZOLLINGER-ELLISON SYNDROME CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 1999-09-14 US disclosed
US-5633218-A CONTROLLING WEEDS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1997-05-27 US disclosed
CN-1117727-A Indolin-2-one derivative CHUGAI PHARMACEUTICAL CO LTD (JP) 1996-02-28 CN disclosed
EP-0685463-A1 INDOLIN-2-ONE DERIVATIVE CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 1995-12-06 EP disclosed
US-5380423-A Uranyl complex, sensitive to dihydrogen phosphate anions, fertilizer analysis PRIVA AGRO HOLDING B.V. (NL) 1995-01-10 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 (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-20230333019-A1 TWO-PHOTON FLUORESCENT PROBES FOR SIMULTANEOUSLY DETECTING CALCIUM IONS IN ORGANELLES AND LYSOSOMAL PROTONS CHERP, MCU, LETM1 POLB 4057/4885HDAC3 2446/4885HDAC1 3548/4885
US-20170121344-A1 THIENOPYRIDINE DERIVATIVES FOR THE TREATMENT AND PREVENTION OF DENGUE VIRUS INFECTIONS TTPA, TPMT, SLC19A2 POLB 4278/4885HDAC3 1640/4885HDAC1 2863/4885

“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.