SCHEMBL9665256

SCHEMBL9665256

O=C(O)CCCCCBr.c1ccc(P(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 2/20 0.55
HDAC4 P56524 2/20 0.55
HDAC1 Q13547 2/20 0.55
HDAC7 Q8WUI4 2/20 0.55
HDAC2 Q92769 2/20 0.55
HDAC10 Q969S8 2/20 0.55
HDAC11 Q96DB2 2/20 0.55
HDAC8 Q9BY41 2/20 0.55
HDAC6 Q9UBN7 2/20 0.55
HDAC9 Q9UKV0 2/20 0.55
HDAC5 Q9UQL6 2/20 0.55
MAPT P10636 2/20 0.50
RXFP1 Q9HBX9 1/20 0.50
LMNA P02545 3/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
NPSR1 Q6W5P4 1/20 0.45
MAPK1 P28482 2/20 0.44
ADRA1A P35348 1/20 0.44
SLC6A3 Q01959 1/20 0.44

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
SCHEMBL10472224 1.00 HDAC3 (0.55) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL7619905 1.00 HDAC3 (0.55) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL9578909 1.00 HDAC3 (0.55) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL11794783 1.00 HDAC3 (0.55) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL434414 0.98 HDAC3 (0.52) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL2443584 0.93 HDAC3 (0.47) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL25222408 0.86 HDAC3 (0.47) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL435538 0.85 CYP3A4 (0.50) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL18115142 0.84 TDP1 (0.60) HDAC3HDAC4HDAC1HDAC7HDAC2
Biphenyl SCHEMBL8022864 0.83 HDAC1 (0.60) HDAC3HDAC4HDAC1HDAC7HDAC2

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 20 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4661876-A1 METABOLIC INHIBITORS AND METHODS OF MAKING AND USING THEREOF University of Miami (US) 2025-12-17 EP disclosed
WO-2025077836-A1 IONIZABLE LIPIDS AND LIPID NANOPARTICLES FOR RNA DELIVERY BEIGENE SWITZERLAND GMBH (CH) 2025-04-17 WO disclosed
CN-118772304-A Quaternary phosphonium pullulan and preparation method and application thereof 烟台先进材料与绿色制造山东省实验室 2024-10-15 CN disclosed
WO-2024168133-A1 METABOLIC INHIBITORS AND METHODS OF MAKING AND USING THEREOF UNIVERSITY OF MIAMI (US) 2024-08-15 WO disclosed
CN-116615251-A Antibody-drug conjugates comprising GLP1 peptide mimetics and the uses thereof 瑞泽恩制药公司 2023-08-18 CN disclosed
CN-115337297-A CPI-613 mitochondrion targeted small molecule prodrug, self-assembled nanoparticles thereof, preparation method and application 沈阳药科大学 2022-11-15 CN disclosed
CN-105520941-B Substituted gamma lactams as therapeutic agents 阿勒根公司 2020-05-01 CN disclosed
CN-110799516-A Azithromycin derivatives containing phosphonium ions as anticancer agents 来兴泰德基金会 2020-02-14 CN disclosed
EP-0273647-B1 COUMARAN DERIVATIVES, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1992-03-11 EP disclosed
US-4921866-A 1,3-dioxanes IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-05-01 US disclosed
US-4857516-A Coumaran derivatives and their pharmaceutical use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1989-08-15 US disclosed
US-4837363-A GASTRIC ACID SECRETION INHIBITORS, ANTIULCER AGENTS GLAXO GROUP LIMITED (GB) 1989-06-06 US disclosed
US-4824993-A SYNTHETIC PROSTAGLANDINS, ANTISECRETORY AGENTS GLAXO GROUP LIMITED (GB) 1989-04-25 US disclosed
EP-0160495-B1 CYCLOPENTYL ETHERS AND THEIR PREPARATION AND PHARMACEUTICAL FORMULATION GLAXO GROUP LTD (GB) 1989-01-11 EP disclosed
EP-0273647-A1 Coumaran derivatives, their production and use Takeda Chemical Industries, Ltd. (JP) 1988-07-06 EP disclosed
EP-0160495-A2 Cyclopentyl ethers and their preparation and pharmaceutical formulation GLAXO GROUP LIMITED (GB) 1985-11-06 EP disclosed
US-4536515-A Substituted phenylalkenoic acids and esters MERCK FROSST CANADA, INC. (CA) 1985-08-20 US disclosed
US-4453005-A Process for preparing substituted phenylalkenoic acids MERCK FROSST CANADA, INC. (CA) 1984-06-05 US disclosed
US-4420626-A Dioxatricyclic prostacyclin analogs E. R. SQUIBB & SONS, INC. (US) 1983-12-13 US disclosed
US-4360685-A Dioxatricyclic prostacyclin analogs E. R. SQUIBB & SONS, INC. (US) 1982-11-23 US disclosed