SCHEMBL3884491

SCHEMBL3884491

C[CH]CCC(CC)CCCC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.50
TDP1 Q9NUW8 2/20 0.50
CYP3A4 P08684 5/20 0.48
TSHR P16473 5/20 0.48
CA2 P00918 3/20 0.45
L3MBTL1 Q9Y468 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.38
ATM Q13315 1/20 0.37
LMNA P02545 2/20 0.34
CYP2D6 P10635 2/20 0.34
CHRM2 P08172 1/20 0.34
HTR1A P08908 1/20 0.34
ADRA2A P08913 1/20 0.34
ADORA3 P0DMS8 1/20 0.34
CHRM1 P11229 1/20 0.34
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34
OPRM1 P35372 1/20 0.34
DRD3 P35462 1/20 0.34
SLC6A3 Q01959 1/20 0.34

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
SCHEMBL28277714 0.93 ALDH1A1 (0.43) ALDH1A1TDP1CYP3A4TSHRCA2
SCHEMBL28203416 0.91 ALDH1A1 (0.46) ALDH1A1TDP1CYP3A4TSHRCA2
SCHEMBL28271647 0.91 LMNA (0.46) ALDH1A1TDP1CYP3A4TSHRCA2
SCHEMBL28271792 0.91 LMNA (0.46) ALDH1A1TDP1CYP3A4TSHRCA2
SCHEMBL28154786 0.91 LMNA (0.46) ALDH1A1TDP1CYP3A4TSHRCA2
SCHEMBL28161676 0.91 LMNA (0.46) ALDH1A1TDP1CYP3A4TSHRCA2
SCHEMBL377895 0.91 LMNA (0.46) ALDH1A1TDP1CYP3A4TSHRCA2
SCHEMBL28153776 0.91 LMNA (0.46) ALDH1A1TDP1CYP3A4TSHRCA2
SCHEMBL28154741 0.91 LMNA (0.46) ALDH1A1TDP1CYP3A4TSHRCA2
SCHEMBL28154762 0.91 LMNA (0.46) ALDH1A1TDP1CYP3A4TSHRCA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109957128-A A kind of organic film surface coarsening agent, preparation method and its method of roughening 惠州比亚迪电子有限公司 2019-07-02 CN claimed
CN-108795153-A The method of purification of zinc oxide base nano particle ink 深圳TCL工业研究院有限公司 2018-11-13 CN claimed
CN-108624137-A Aqueous quantum dot ink 深圳TCL工业研究院有限公司 2018-10-09 CN claimed
CN-104003841-B The method for preparing the alkoxide of calcium 中国石油大学(华东) 2018-05-25 CN claimed
CN-107293462-A A kind of method that microchannel plate is prepared with polymer carrier 山西省化工研究所(有限公司) 2017-10-24 CN claimed
CN-106554655-A Quantum dot ink and electroluminescent device 苏州星烁纳米科技有限公司 2017-04-05 CN claimed
JP-2004504370-A 2004-02-12 JP claimed
EP-1303472-A1 SECONDARY C 10- 18 SURFACTANT ALCOHOLS BASF AKTIENGESELLSCHAFT (DE) 2003-04-23 EP claimed
WO-2002008164-A1 SECONDARY C10-18 SURFACTANT ALCOHOLS BASF AKTIENGESELLSCHAFT (DE) 2002-01-31 WO claimed
US-4834952-A LIQUID EXTRACTION USING CARBOXYLIC ACID, PHOSPHONIC ACID ESTER, OR HYDROXYQUINOLINE RHONE-POULENC CHIMIE (FR) 1989-05-30 US claimed
CN-87100989-A The method of purification of barium salt 1987-09-30 CN claimed
CN-108950247-B Extraction system and application thereof 中国科学院上海有机化学研究所 2022-07-19 CN disclosed
US-11246966-B2 Copolymer-comprising antimicrobial, cell culture, antithrombotic, or biopharmaceutical article National University Corporation NARA Institute of Science and Technology (JP) 2022-02-15 US disclosed
US-20200246512-A1 ARTICLE National University Corporation NARA Institute of Science and Technology (JP) 2020-08-06 US disclosed
EP-3650054-A1 ARTICLE National University Corporation Nara Institute of Science and Technology (JP) 2020-05-13 EP disclosed
EP-0008368-A1 Method for preparing cyano compounds BASF Aktiengesellschaft (DE) 1980-03-05 EP disclosed
US-4167573-A Method of controlling fungi with 3,5-dimethyl-piperidin-4-ones BASF AKTIENGESELLSCHAFT (DE) 1979-09-11 US disclosed
US-4158559-A HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1979-06-19 US disclosed
US-4080507-A MAKING TEXTILES OIL AND WATER REPELLENT FMC CORPORATION (US) 1978-03-21 US disclosed
US-4075004-A HERBICIDES BASF AKTIENGESELLSCHAFT (DT) 1978-02-21 US disclosed