SCHEMBL598016

SCHEMBL598016

O=C(O)CCCC(Br)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LCK P06239 1/20 0.56
PPARD Q03181 1/20 0.56
ZDHHC20 Q5W0Z9 1/20 0.56
ZDHHC2 Q9UIJ5 1/20 0.56
LMNA P02545 2/20 0.48
SLC22A6 Q4U2R8 1/20 0.48
TSHR P16473 2/20 0.46
ALDH1A1 P00352 1/20 0.46
NFKB1 P19838 1/20 0.46
PMP22 Q01453 1/20 0.46
FOLH1 Q04609 3/20 0.45
ENPEP Q07075 2/20 0.45
GSTK1 Q9Y2Q3 2/20 0.45
TET2 Q6N021 3/20 0.42
KDM4A O75164 2/20 0.42
KDM4C Q9H3R0 2/20 0.42
KDM2A Q9Y2K7 2/20 0.42
TET3 O43151 1/20 0.42
CAMK2A Q9UQM7 1/20 0.42
CYP1A2 P05177 2/20 0.41

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
SCHEMBL11536608 0.93 LCK (0.59) LCKPPARDZDHHC20ZDHHC2LMNA
SCHEMBL11535630 0.91 PPARD (0.63) LCKPPARDZDHHC20ZDHHC2LMNA
SCHEMBL11538770 0.91 PPARD (0.63) LCKPPARDZDHHC20ZDHHC2LMNA
SCHEMBL28978909 0.91 PPARD (0.63) LCKPPARDZDHHC20ZDHHC2LMNA
SCHEMBL11539998 0.91 PPARD (0.63) LCKPPARDZDHHC20ZDHHC2LMNA
SCHEMBL11534282 0.91 PPARD (0.63) LCKPPARDZDHHC20ZDHHC2LMNA
SCHEMBL11532880 0.91 PPARD (0.63) LCKPPARDZDHHC20ZDHHC2LMNA
SCHEMBL27970253 0.89 PPARD (0.61) LCKPPARDZDHHC20ZDHHC2LMNA
SCHEMBL27972860 0.89 PPARD (0.61) LCKPPARDZDHHC20ZDHHC2LMNA
SCHEMBL27970184 0.89 PPARD (0.61) LCKPPARDZDHHC20ZDHHC2LMNA

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-106753823-A A kind of surfactant containing selenium responded with pH and redox dual-switch 江南大学 2017-05-31 CN claimed
US-4154740-A HERBICIDES, ANIMAL GROWTH REGULATORS AMERICAN CYANAMID COMPANY (US) 1979-05-15 US claimed
US-4153611-A ANIMAL GROWTH REGULATORS AMERICAN CYANAMID COMPANY (US) 1979-05-08 US claimed
US-4042571-A Fire-retardant polyamides from naphthalene dicarboxylic reactant and halogenated carboxylic reactant TEIJIN LIMITED (JA) 1977-08-16 US claimed
CN-115350111-B Lignin-based stimulus-responsive long-acting broad-spectrum ultraviolet-resistant protective material and preparation and application thereof 华南理工大学 2023-10-20 CN disclosed
WO-2020253077-A1 USE OF DICARBOXYLIC ACID COMPOUNDS FOR CONTROLLING PLANT DISEASES CHINA AGRICULTURAL UNIVERSITY (CN) 2020-12-24 WO disclosed
CN-107065466-B The electrostatic printing of cyclodextrin composite 塞尔瑞星技术有限公司 2019-08-20 CN disclosed
CN-108137900-A Curable composition 株式会社钟化 2018-06-08 CN disclosed
CN-107065466-A The electrostatic printing of cyclodextrin composite 塞尔瑞星技术有限公司 2017-08-18 CN disclosed
CN-106753823-A A kind of surfactant containing selenium responded with pH and redox dual-switch 江南大学 2017-05-31 CN disclosed
EP-2457914-B1 Compounds comprising short aminoalcohol chains and metal complexes for medical imaging GUERBET SA (FR) 2014-08-06 EP disclosed
US-8268810-B2 Lipophilic chelates and their use in imaging GUERBET (FR) 2012-09-18 US disclosed
US-4248966-A FROM TRIPEPTIDES IN CEPHALOSPORIUM EXTRACT MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 1981-02-03 US disclosed
US-4180660-A CONTAINING FORMYL SUBSTITUTED PYRROLE GROUP YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 1979-12-25 US disclosed
US-4148998-A ANTIBIOTICS YEDA RESEARCH AND DEVELOPMENT CO., LTD. (IL) 1979-04-10 US disclosed
US-4122260-A CONTAINING FORMYL SUBSTITUTED PYRROLE, ANTIBIOTICS YEDA RESEARCH AND DEVELOPMENT CO., LTD. (IL) 1978-10-24 US disclosed
US-4086251-A POLYPROPYLENE, POLYBUTYLENE WITH AN ANHYDRIDE STANDARD OIL COMPANY (INDIANA) (US) 1978-04-25 US disclosed
US-4042571-A Fire-retardant polyamides from naphthalene dicarboxylic reactant and halogenated carboxylic reactant TEIJIN LIMITED (JA) 1977-08-16 US disclosed
US-4008168-A Polybutene composition containing halogen-containing additives and use thereof STANDARD OIL COMPANY (INDIANA) (US) 1977-02-15 US disclosed
US-3954812-A REACTING POLYBUTENE AND MALEIC ANHYDRIDE STANDARD OIL COMPANY (US) 1976-05-04 US disclosed