SCHEMBL202055

SCHEMBL202055

COc1ccc(C(=O)CBr)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 4/20 1.00
HDAC3 O15379 2/20 0.66
HDAC4 P56524 2/20 0.66
HDAC1 Q13547 2/20 0.66
HDAC7 Q8WUI4 2/20 0.66
HDAC2 Q92769 2/20 0.66
HDAC10 Q969S8 2/20 0.66
HDAC11 Q96DB2 2/20 0.66
HDAC8 Q9BY41 2/20 0.66
HDAC6 Q9UBN7 2/20 0.66
HDAC9 Q9UKV0 2/20 0.66
HDAC5 Q9UQL6 2/20 0.66
MAPT P10636 1/20 0.59
CES2 O00748 1/20 0.59
CES1 P23141 1/20 0.59
PDE4B Q07343 1/20 0.58
CA1 P00915 3/20 0.57
CA2 P00918 3/20 0.57
PTPN1 P18031 2/20 0.57
NPC1 O15118 1/20 0.56

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
Ammonia Solution, Strong SCHEMBL17626749 0.98 GSK3B (0.96) GSK3BHDAC3HDAC4HDAC1HDAC7
SCHEMBL2773360 0.94 GSK3B (0.89) GSK3BHDAC3HDAC4HDAC1HDAC7
SCHEMBL7390281 0.94 GSK3B (0.89) GSK3BHDAC3HDAC4HDAC1HDAC7
SCHEMBL8103554 0.88 GSK3B (0.77) GSK3BHDAC3HDAC4HDAC1HDAC7
SCHEMBL8557179 0.87 GSK3B (0.75) GSK3BMAPTNPC1RAB9AALDH1A1
SCHEMBL4328500 0.85 GSK3B (0.73) GSK3BHDAC3HDAC4HDAC1HDAC7
SCHEMBL7314253 0.84 GSK3B (0.72) GSK3BHDAC3HDAC4HDAC1HDAC7
SCHEMBL571370 0.83 GSK3B (0.71) GSK3BHDAC3HDAC4HDAC1HDAC7
SCHEMBL31065275 0.83 GSK3B (0.71) GSK3BHDAC3HDAC4HDAC1HDAC7
SCHEMBL153386 0.83 ALDH1A1 (0.76) GSK3BHDAC3HDAC4HDAC1HDAC7

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

Appears in 2242 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250333698-A1 SIRPa DEFICIENT MACROPHAGES FOR TREATING CANCER UNIV GEORGIA STATE RES FOUND (US) 2025-10-30 US claimed
CN-120081843-A Fluorescent probe for quantitatively detecting NO in exhaled breath, and preparation method and application thereof 阜阳师范大学 2025-06-03 CN claimed
CN-119930621-A Fungus-inhibiting matrine hydrazine thiazole derivative and preparation method and application thereof 南京林业大学 2025-05-06 CN claimed
WO-2025059259-A1 NEW PROCESS FOR PHENYLEPHRINE AND SALBUTAMOL AND RELATED COMPOUNDS VIA ASYMETRIC TRANSFER HYDROGENATION OF UNPROTECTED AMINO KETONES VIRGINIA COMMONWEALTH UNIVERSITY (US) 2025-03-20 WO claimed
CN-118930487-A 1,3, 5-Trisubstituted pyrazole compound and preparation method thereof 赣南师范大学 2024-11-12 CN claimed
CN-118908971-A Oxygen bridge bicyclo- [2.2.1] -heptene compound containing different sulfonamide nitrogen atom substituents, and preparation method and application thereof 湖北大学 2024-11-08 CN claimed
EP-4423251-A1 SIRP ALPHA DEFICIENT MACROPHAGES FOR TREATING CANCER Georgia State University Research Foundation, Inc. (US) 2024-09-04 EP claimed
CN-118324975-A Phenothiazine skeleton macromolecule cationic photoinitiator and preparation method and application thereof 江南大学 2024-07-12 CN claimed
CN-118176293-A SIRPalpha-deficient macrophages for the treatment of cancer 佐治亚州立大学研究基金会公司 2024-06-11 CN claimed
CN-115557865-B Thioether-promoted cysteine-based bioconjugate method 南京工业大学 2024-05-14 CN claimed
WO-2006079090-A2 PROCESS FOR THE PREPARATION OF FENOLDOPAM MESYLATE SICOR INC. (US) 2006-07-27 WO claimed
JP-2004505888-A 2004-02-26 JP claimed
EP-1263763-A2 TUBULIN BINDING LIGANDS AND CORRESPONDING PRODRUG CONSTRUCTS BAYLOR UNIVERSITY (US) 2002-12-11 EP claimed
US-20020061895-A1 6-fluoro-1,4-dihydro-7-[4-(2-hydroxyiminoethyl)-1-piperazinyl]-4-oxoquinoline-3-carboxylic acid derivatives, their preparation and pharmaceutical compositions PHARMACEUTICAL INDUSTRY TECHNOLOGY 2002-05-23 US claimed
US-20020055643-A1 Tubulin binding ligands and corresponding prodrug constructs MATEON THERAPEUTICS, INC. 2002-05-09 US claimed
WO-2001068654-A2 TUBULIN BINDING LIGANDS AND CORRESPONDING PRODRUG CONSTRUCTS BAYLOR UNIVERSITY (US) 2001-09-20 WO claimed
EP-0674233-B1 Recording sheets XEROX CORP (US) 2000-05-24 EP claimed
US-5928765-A Recording sheets XEROX CORPORATION (US) 1999-07-27 US claimed
EP-0674233-A2 Recording sheets XEROX CORPORATION (US) 1995-09-27 EP claimed
US-4328356-A Process for preparing esters of arylacetic acids from alpha-halo-alkylarylketones MONTEDISON S.P.A. (IT) 1982-05-04 US claimed