SCHEMBL7615550

SCHEMBL7615550

CCc1cc(-c2ccccc2)cc(CC)c1N

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.44
HTT P42858 1/20 0.44
PTGS1 P23219 1/20 0.43
PTPN1 P18031 2/20 0.42
PTPN2 P17706 1/20 0.42
PTPN6 P29350 1/20 0.42
MAOA P21397 1/20 0.41
CYP3A4 P08684 1/20 0.41
TAAR1 Q96RJ0 1/20 0.41
HSD17B10 Q99714 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
MAPT P10636 3/20 0.39
L3MBTL1 Q9Y468 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
ALDH1A1 P00352 2/20 0.39
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
CA9 Q16790 2/20 0.39
DHFR P00374 1/20 0.38
HEXA P06865 1/20 0.38

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
SCHEMBL24385313 0.88 ALDH1A1 (0.46) POLBHTTPTGS1PTPN1PTPN2
SCHEMBL2186186 0.86 HTT (0.54) POLBHTTCYP3A4TAAR1TDP1
SCHEMBL9325163 0.86 PTGS1 (0.47) POLBHTTPTGS1PTPN1HSD17B10
Hydrochloric Acid SCHEMBL9751581 0.84 HTT (0.52) POLBHTTCYP3A4TAAR1TDP1
SCHEMBL29656878 0.84 HTT (0.52) POLBHTTCYP3A4TAAR1TDP1
Methane SCHEMBL27855766 0.84 HTT (0.52) POLBHTTCYP3A4TAAR1TDP1
SCHEMBL10979678 0.83 TDP1 (0.48) POLBHTTCYP3A4TAAR1HSD17B10
Formaldehyde SCHEMBL22802133 0.81 HTT (0.50) POLBHTTCYP3A4TAAR1TDP1
SCHEMBL20572544 0.81 HTT (0.50) POLBHTTCYP3A4TAAR1TDP1
SCHEMBL29068247 0.80 PTGS1 (0.44) POLBPTGS1PTPN1PTPN2PTPN6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117753387-A Covalent organic framework nanocapsule material and emulsion acceleration polymerization method thereof 浙江大学 2024-03-26 CN claimed
CN-114539498-B Water-phase-dispersible composite material based on covalent organic framework and application thereof 浙江大学 2023-07-14 CN claimed
CN-114539498-A Water-phase dispersible composite material based on covalent organic framework and application thereof 浙江大学 2022-05-27 CN claimed
CN-113004532-A Metamaterial based on covalent organic framework and application of metamaterial in optical device 浙江大学 2021-06-22 CN claimed
CN-110339862-A A kind of alpha-diimine palladium catalyst and preparation method thereof that contraposition phenyl replaces 江苏高科石化股份有限公司 2019-10-18 CN claimed
CN-117753387-A Covalent organic framework nanocapsule material and emulsion acceleration polymerization method thereof 浙江大学 2024-03-26 CN disclosed
CN-114539498-B Water-phase-dispersible composite material based on covalent organic framework and application thereof 浙江大学 2023-07-14 CN disclosed
CN-113004532-B Metamaterial based on covalent organic framework and application of metamaterial in optical device 浙江大学 2022-07-15 CN disclosed
CN-114539498-A Water-phase dispersible composite material based on covalent organic framework and application thereof 浙江大学 2022-05-27 CN disclosed
CN-113004532-A Metamaterial based on covalent organic framework and application of metamaterial in optical device 浙江大学 2021-06-22 CN disclosed
CN-110339862-A A kind of alpha-diimine palladium catalyst and preparation method thereof that contraposition phenyl replaces 江苏高科石化股份有限公司 2019-10-18 CN disclosed
EP-1185506-A1 SUBSTITUTED ARYLMALONIC ACID DINITRILES AS INTERMEDIATES FOR THE PREPARATION OF HERBICIDES Syngenta Participations AG (CH) 2002-03-13 EP disclosed
WO-2000078712-A1 SUBSTITUTED ARYLMALONIC ACID DINITRILES AS INTERMEDIATES FOR THE PREPARTION OF HERBICIDES SYNGENTA PARTICIPATIONS AG (CH) 2000-12-28 WO disclosed