SCHEMBL767141

SCHEMBL767141

CC(=O)C(=O)c1ccc(Br)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 3/20 0.71
CES1 P23141 3/20 0.71
CA1 P00915 2/20 0.52
CA2 P00918 2/20 0.52
HTT P42858 1/20 0.52
GSK3B P49841 2/20 0.48
KMT2A Q03164 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
LMNA P02545 4/20 0.47
RAB9A P51151 2/20 0.47
MAPT P10636 2/20 0.47
MEN1 O00255 1/20 0.47
MAPK1 P28482 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
RXFP1 Q9HBX9 1/20 0.47
OGG1 O15527 1/20 0.46
HDAC3 O15379 1/20 0.45
HDAC4 P56524 1/20 0.45
HDAC1 Q13547 1/20 0.45
HDAC7 Q8WUI4 1/20 0.45

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
SCHEMBL557285 0.84 CES2 (1.00) CES2CES1CA1CA2HTT
SCHEMBL10888312 0.81 CES2 (0.65) CES2CES1CA1CA2HTT
SCHEMBL28385234 0.79 CES2 (0.62) CES2CES1CA1CA2HTT
SCHEMBL13444902 0.79 CES2 (0.64) CES2CES1KMT2AL3MBTL1LMNA
SCHEMBL17187852 0.79 CES2 (0.62) CES2CES1CA1CA2GSK3B
SCHEMBL20102 0.79 CES2 (0.62) CES2CES1CA1CA2GSK3B
SCHEMBL5388314 0.78 CES2 (0.76) CES2CES1CA1CA2HTT
SCHEMBL11372320 0.78 CES2 (0.60) CES2CES1CA1CA2HTT
SCHEMBL10813399 0.78 CES2 (0.60) CES2CES1CA1CA2HTT
SCHEMBL10813395 0.78 CES2 (0.60) CES2CES1CA1CA2HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122094688-A Compositions and methods for treating pulmonary arterial hypertension 2026-05-26 CN disclosed
US-20250381196-A1 ALPHA PROTEIN KINASE 1 INHIBITORS FOR USE IN TREATING KIDNEY DISEASES AND KIDNEY-RELATED DISEASES SHANGHAI YAO YUAN BIOTECHNOLOGY CO LTD (CN) 2025-12-18 US disclosed
US-20250241908-A1 ALPHA PROTEIN KINASE 1 INHIBITORS FOR USE IN TREATING ATHEROSCLEROSIS AND RELATED DISEASES NINGBO MEISHAN BONDED PORT AREA ZHEJIANG UNITED INVESTMENT MANAGEMENT CO., LTD. (CN) 2025-07-31 US disclosed
CN-119997953-A Alpha protein kinase 1 inhibitors for the treatment of kidney diseases and kidney related diseases 上海药苑生物科技有限公司 2025-05-13 CN disclosed
EP-4543443-A1 ALPHA PROTEIN KINASE 1 INHIBITORS FOR USE IN TREATING KIDNEY DISEASES AND KIDNEY-RELATED DISEASES Shanghai Yao Yuan Biotechnology Co., Ltd. (CN) 2025-04-30 EP disclosed
WO-2025082485-A1 COMPOSITION AND METHODS FOR THE TREATMENT OF PULMONARY ARTERIAL HYPERTENSION SHANGHAI YAO YUAN BIOTECHNOLOGY CO., LTD. (CN) 2025-04-24 WO disclosed
US-20240226094-A1 ALPHA PROTEIN KINASE 1 INHIBITORS FOR USE IN TREATING KAWASAKI DISEASE XU, Cong (CN) 2024-07-11 US disclosed
US-20240226094-A1 ALPHA PROTEIN KINASE 1 INHIBITORS FOR USE IN TREATING KAWASAKI DISEASE XU, Cong (CN) 2024-07-11 US disclosed
US-20240226094-A1 ALPHA PROTEIN KINASE 1 INHIBITORS FOR USE IN TREATING KAWASAKI DISEASE XU, Cong (CN) 2024-07-11 US disclosed
CN-118103045-A Alpha protein kinase 1 inhibitors for the treatment of kawasaki disease 上海药苑生物科技有限公司 2024-05-28 CN disclosed
US-20170368032-A1 Imidazole-Based Antimicrobial Agents PROCOMCURE BIOTECH GMBH (AT) 2017-12-28 US disclosed
US-20170340613-A1 Novel Imidazole-Based Heterocyclic Compounds PROCOMCURE BIOTECH GMBH (AT) 2017-11-30 US disclosed
US-20170334887-A1 Imidazole-Based Antimicrobial Agents PROCOMCURE BIOTECH GMBH (AT) 2017-11-23 US disclosed
EP-3226858-A1 IMIDAZOLE-BASED ANTIMICROBIAL AGENTS Procomcure Biotech GmbH (AT) 2017-10-11 EP disclosed
WO-2016087616-A1 IMIDAZOLE-BASED ANTIMICROBIAL AGENTS PROCOMCURE BIOTECH GMBH (AT) 2016-06-09 WO disclosed
WO-2016087618-A1 IMIDAZOLE-BASED ANTIMICROBIAL AGENTS PROCOMCURE BIOTECH GMBH (AT) 2016-06-09 WO disclosed
WO-2016087615-A1 NOVEL IMIDAZOLE-BASED HETEROCYCLIC COMPOUNDS PROCOMCURE BIOTECH GMBH (AT) 2016-06-09 WO disclosed
EP-2619200-A2 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM Calcimedica, Inc. (US) 2013-07-31 EP disclosed
WO-2012040511-A2 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA, INC. (US) 2012-03-29 WO disclosed
US-20120071516-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM CALCIMEDICA, INC. (US) 2012-03-22 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 (7 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-20240226094-A1 ALPHA PROTEIN KINASE 1 INHIBITORS FOR USE IN TREATING KAWASAKI DISEASE PHKA1, PHKA2, PHKG1 CES2 3819/4885CES1 943/4885CA1 3695/4885
US-20170334887-A1 Imidazole-Based Antimicrobial Agents TLR5, NISCH, SLC11A2 CES2 3407/4885CES1 2890/4885CA1 4811/4885
US-20250241908-A1 ALPHA PROTEIN KINASE 1 INHIBITORS FOR USE IN TREATING ATHEROSCLEROSIS AND RELATED DISEASES PHKA1, PHKA2, PHKG1 CES2 3744/4885CES1 369/4885CA1 4741/4885
US-20170368032-A1 Imidazole-Based Antimicrobial Agents TLR5, NISCH, SLC11A2 CES2 3407/4885CES1 2890/4885CA1 4811/4885
US-20250381196-A1 ALPHA PROTEIN KINASE 1 INHIBITORS FOR USE IN TREATING KIDNEY DISEASES AND KIDNEY-RELATED DISEASES PHKA1, PHKA2, PHKG1 CES2 4417/4885CES1 715/4885CA1 4554/4885
US-20120071516-A1 COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM ORAI1, SARAF, RYR2 CES2 2132/4885CES1 2069/4885CA1 1250/4885
US-20170340613-A1 Novel Imidazole-Based Heterocyclic Compounds SLC11A2, MIF, NISCH CES2 2382/4885CES1 1767/4885CA1 4750/4885

“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.