SCHEMBL22609165

SCHEMBL22609165

CCO[Si](CCCNc1ccc([N+](=O)[O-])cc1)(OCC)OCC

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.57
SMN1; SMN2 Q16637 3/20 0.57
GLA P06280 2/20 0.57
MAPT P10636 14/20 0.54
KDM4E B2RXH2 2/20 0.53
HPGD P15428 1/20 0.51
ALOX12 P18054 1/20 0.51
GAA P10253 2/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
PKM P14618 1/20 0.47
HTT P42858 2/20 0.45
LMNA P02545 1/20 0.45
RAB9A P51151 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
SCHEMBL6275597 0.83 HTT (0.58) ALDH1A1SMN1; SMN2GLAMAPTMEN1
SCHEMBL5718646 0.81 ALDH1A1 (0.64) ALDH1A1SMN1; SMN2GLAMAPTKDM4E
SCHEMBL29351451 0.81 MAPT (0.63) ALDH1A1SMN1; SMN2MAPTKDM4EGAA
SCHEMBL303646 0.81 MAPT (0.63) ALDH1A1SMN1; SMN2MAPTKDM4EGAA
SCHEMBL1558275 0.80 MAPT (0.58) ALDH1A1SMN1; SMN2MAPTKDM4EALOX12
SCHEMBL5684774 0.79 MAPT (0.52) ALDH1A1SMN1; SMN2MAPTKDM4EHPGD
SCHEMBL9651956 0.79 MAPT (0.68) ALDH1A1SMN1; SMN2GLAMAPTKDM4E
SCHEMBL4951837 0.78 ALDH1A1 (0.73) ALDH1A1SMN1; SMN2GLAMAPTKDM4E
SCHEMBL5685426 0.78 MAPT (0.42) ALDH1A1MAPTHPGDALOX12GAA
SCHEMBL13902545 0.78 ALDH1A1 (0.57) ALDH1A1SMN1; SMN2GLAMAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115992351-A Surface treatment agent for metal material, metal material having surface treatment film, and method for producing same 日本帕卡濑精株式会社 2023-04-21 CN disclosed
US-11603592-B2 Metallic material surface treatment agent, metallic material having surface treatment coating, and manufacturing method therefor NIHON PARKERIZING CO., LTD. (JP) 2023-03-14 US disclosed
US-20200362461-A1 Metallic Material Surface Treatment Agent, Metallic Material Having Surface Treatment Coating, and Manufacturing Method Therefor NIHON PARKERIZING CO., LTD. (JP) 2020-11-19 US disclosed
EP-3733929-A1 METALLIC MATERIAL SURFACE TREATMENT AGENT, METALLIC MATERIAL HAVING SURFACE TREATMENT COATING, AND MANUFACTURING METHOD THEREFOR Nihon Parkerizing Co., Ltd. (JP) 2020-11-04 EP disclosed
CN-111511963-A Surface treatment agent for metal material, metal material having surface treatment film, and method for producing same 日本帕卡濑精株式会社 2020-08-07 CN disclosed