SCHEMBL29453552

SCHEMBL29453552

CCCCCCCCCCCCC1(CCCCCCCCCCCC)c2ccccc2-c2ccccc21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 1/20 0.47
MMP2 P08253 4/20 0.46
MMP9 P14780 4/20 0.46
MMP8 P22894 2/20 0.46
MMP13 P45452 2/20 0.46
PDK2 Q15119 3/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
MMP3 P08254 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
RECQL P46063 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
PTPN1 P18031 1/20 0.38
ELANE P08246 1/20 0.38
PGR P06401 1/20 0.37
CES1 P23141 2/20 0.37
CDC25A P30304 1/20 0.37

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
SCHEMBL1681761 1.00 APEX1 (0.47) APEX1MMP2MMP9MMP8MMP13
SCHEMBL6060794 1.00 APEX1 (0.47) APEX1MMP2MMP9MMP8MMP13
SCHEMBL1395294 1.00 APEX1 (0.47) APEX1MMP2MMP9MMP8MMP13
SCHEMBL6060689 1.00 APEX1 (0.47) APEX1MMP2MMP9MMP8MMP13
SCHEMBL6060635 1.00 APEX1 (0.47) APEX1MMP2MMP9MMP8MMP13
SCHEMBL6060916 1.00 APEX1 (0.47) APEX1MMP2MMP9MMP8MMP13
SCHEMBL14736023 1.00 APEX1 (0.47) APEX1MMP2MMP9MMP8MMP13
SCHEMBL1395156 1.00 APEX1 (0.47) APEX1MMP2MMP9MMP8MMP13
SCHEMBL17034549 1.00 APEX1 (0.47) APEX1MMP2MMP9MMP8MMP13
SCHEMBL30536393 1.00 APEX1 (0.47) APEX1MMP2MMP9MMP8MMP13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117916587-A Resistive hydrogen sensor comprising a sensing layer with semiconducting single-walled carbon nanotubes and method for manufacturing the same 浦项工科大学校产学协力团 2024-04-19 CN claimed
CN-110300727-B Decomposable S-tetrazine polymers for single wall carbon nanotube applications 加拿大国家研究委员会 2023-05-02 CN claimed
CN-117916587-A Resistive hydrogen sensor comprising a sensing layer with semiconducting single-walled carbon nanotubes and method for manufacturing the same 浦项工科大学校产学协力团 2024-04-19 CN disclosed
CN-116622040-A Fluorene and pyrrolo-dithiophene-based polymer and preparation method and application thereof 山西大学 2023-08-22 CN disclosed
CN-110300727-B Decomposable S-tetrazine polymers for single wall carbon nanotube applications 加拿大国家研究委员会 2023-05-02 CN disclosed
CN-114149568-A Preparation method of polyfluorene material and obtained polyfluorene material 北京化工大学 2022-03-08 CN disclosed