SCHEMBL5054802

SCHEMBL5054802

O=C(O)CC(Br)C(=O)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALKBH5 Q6P6C2 1/20 0.47
MDM2 Q00987 1/20 0.47
TDP1 Q9NUW8 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
CES1 P23141 4/20 0.45
CES2 O00748 3/20 0.45
LMNA P02545 1/20 0.45
TSHR P16473 2/20 0.44
PTPN1 P18031 1/20 0.43
GSK3B P49841 1/20 0.43
PGR P06401 1/20 0.43
ADRA2A P08913 1/20 0.43
ADRA2B P18089 1/20 0.43
HTR2A P28223 1/20 0.43
HRH1 P35367 1/20 0.43
KCNH2 Q12809 1/20 0.43
MMP2 P08253 2/20 0.42
MMP9 P14780 2/20 0.42
MMP12 P39900 2/20 0.42
MMP14 P50281 1/20 0.42

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
SCHEMBL11405755 0.89 PTPN1 (0.50) L3MBTL1LMNATSHRPTPN1GSK3B
SCHEMBL10931231 0.84 SRD5A2 (0.50) MMP12HPGDSMN1; SMN2ALDH1A1
SCHEMBL15158418 0.84 PGR (0.44) ALKBH5MDM2TDP1L3MBTL1CES1
SCHEMBL19328379 0.84 CES2 (0.45) L3MBTL1CES1CES2GSK3BMEN1
SCHEMBL5052427 0.82 MMP2 (0.47) CES1CES2PTPN1GSK3BMMP2
SCHEMBL19328352 0.82 KMT2A (0.47) CES1CES2LMNAGSK3BADRA2B
SCHEMBL5055106 0.82 CYP2C9 (0.51) L3MBTL1CES1CES2LMNATSHR
SCHEMBL19341769 0.81 SLC6A2 (0.40) MDM2CES1CES2TSHRGSK3B
SCHEMBL5055096 0.81 CES2 (0.51) L3MBTL1CES1CES2LMNATSHR
SCHEMBL4092391 0.80 KCNA5 (0.48) MDM2TDP1L3MBTL1TSHRPGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2586780-B1 2-ARYL IMIDAZO[1,2-A]PYRIDINE-3-ACETAMIDE DERIVATIVES, PREPARATION METHODS AND USE THEREOF INST PHARMACOLOGY & TOXICOLOGY ACAD MILITARY MEDICAL SCIENCES PLA CHINA (CN) 2017-03-22 EP disclosed
US-8980887-B2 2-aryl imidazo[1,2-a]pyridine-3-acetamide derivatives, preparation methods and uses thereof INSTITUTE OF PHARMACOLOGY (CN) 2015-03-17 US disclosed
US-20130203754-A1 2-Aryl Imidazo[1,2-a]Pyridine-3-Acetamide Derivatives, Preparation Methods and Uses Thereof INSTITUTE OF PHARMACOLOGY AND TOXICOLOGY ACADEMY OF MILITARY MEDICAL SCIENCES P.L.A. CHINA (CN) 2013-08-08 US disclosed
US-20080119456-A1 Substituted Thiazoleacetic Acid as Crth2 Ligands 7TM PHARMA A/S (DK) 2008-05-22 US disclosed
US-20080119456-A1 Substituted Thiazoleacetic Acid as Crth2 Ligands 7TM PHARMA A/S (DK) 2008-05-22 US disclosed
US-20080119456-A1 Substituted Thiazoleacetic Acid as Crth2 Ligands 7TM PHARMA A/S (DK) 2008-05-22 US disclosed
EP-1758874-A1 SUBSTITUTED THIAZOLEACETIC ACIDS AS CRTH2 LIGANDS 7TM Pharma A/S (DK) 2007-03-07 EP disclosed
WO-2006085815-A1 THIAZOLE DERIVATIVES, THEIR PROCESS FOR THEIR PREPARATION AND THEIR USE IN THERAPY ASTRAZENECA AB (SE) 2006-08-17 WO disclosed
WO-2005116001-A1 SUBSTITUTED THIAZOLEACETIC AS CRTH2 LIGANDS 7TM PHARMA A/S (DK) 2005-12-08 WO disclosed
EP-1170009-B1 Thiazolybenzofuran derivatives and their use as SRS-A and leukotiene antagonists FUJISAWA PHARMACEUTICAL CO (JP) 2004-04-07 EP disclosed
WO-1997027190-A1 THIAZOLYLBENZOFURAN DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-07-31 WO disclosed
US-5608109-A AGRICULTURAL AND HORTICULTURAL INSECTICIDE NIHON NOHYAKU CO., LTD. (JP) 1997-03-04 US disclosed
WO-1996015126-A1 FURAN DERIVATIVES FOR INHIBITING PNEUMOCYSTIS CARINII PNEUMONIA, GIARDIA LAMBLIA AND CRYPTOSPORIDIUM PARVUM GEORGIA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 1996-05-23 WO disclosed
CN-1107142-A Hydrazine derivative and application of same NIHON NOHYAKU CO LTD (JP) 1995-08-23 CN disclosed
US-4447604-A ANTICANCER AGENTS JOHN WYETH & BROTHER LIMITED (GB) 1984-05-08 US disclosed
EP-0020785-B1 HEXAHYDRONAPHTHO(1',2':4,5)IMIDAZO(2,1-B)-THIAZOLE DERIVATIVES AND PROCESS FOR PREPARING SAME TEIJIN LIMITED (JP) 1982-11-24 EP disclosed
US-4347369-A IMMUNOLOGY, ANTICARCINOGENIC, ANTIARTHRITIC, ANTHELMINTICS TEIJIN LIMITED (JP) 1982-08-31 US disclosed
US-4302585-A IMMUNOSUPRESSANTS AMERICAN HOME PRODUCTS CORPORATION (US) 1981-11-24 US disclosed
EP-0020785-A1 HEXAHYDRONAPHTHO(1',2':4,5)IMIDAZO(2,1-b)-THIAZOLE DERIVATIVES AND PROCESS FOR PREPARING SAME TEIJIN LIMITED (JP) 1981-01-07 EP disclosed
US-4214089-A Thiazolo[3,2-a]benzimidazoles, imidazo [2,1-b]thiazoles, and related compounds as antineoplastic agents, and enhancers of the immune response AMERICAN HOME PRODUCTS CORPORATION (US) 1980-07-22 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 (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-20130203754-A1 2-Aryl Imidazo[1,2-a]Pyridine-3-Acetamide Derivatives, Preparation Methods and Uses Thereof TSPO, SLC6A1, TBXA2R ALKBH5 4704/4885MDM2 3017/4885TDP1 2234/4885
US-20080119456-A1 Substituted Thiazoleacetic Acid as Crth2 Ligands HRH1, HRH2, HRH3 ALKBH5 4825/4885MDM2 2482/4885TDP1 4837/4885

“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.