SCHEMBL6360683

SCHEMBL6360683

O=C1SCCN1c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
NPC1 O15118 2/20 0.54
RAB9A P51151 2/20 0.54
SIGMAR1 Q99720 3/20 0.48
ALDH1A1 P00352 3/20 0.46
NPSR1 Q6W5P4 1/20 0.46
CNR1 P21554 1/20 0.45
DDB1 Q16531 1/20 0.44
CRBN Q96SW2 1/20 0.44
MAPT P10636 2/20 0.40
KDM4E B2RXH2 1/20 0.40
GAA P10253 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
USP2 O75604 1/20 0.40
POLB P06746 1/20 0.40
HPGD P15428 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
GSK3A P49840 1/20 0.39
GSK3B P49841 1/20 0.39

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
SCHEMBL10386947 0.79 SIGMAR1 (0.54) MEN1KMT2ANPC1RAB9ASIGMAR1
Bromide SCHEMBL10800477 0.78 SIGMAR1 (0.52) MEN1KMT2ANPC1RAB9ASIGMAR1
SCHEMBL3418528 0.75 MAPT (0.47) MEN1KMT2ANPC1RAB9ASIGMAR1
SCHEMBL9207312 0.75 CNR1 (0.33) MEN1KMT2ANPC1RAB9AALDH1A1
SCHEMBL9199607 0.73 DRD2 (0.50) SIGMAR1
SCHEMBL10933135 0.72 ALDH1A1 (0.55) MEN1KMT2ANPC1RAB9ASIGMAR1
SCHEMBL17704774 0.70 NPC1 (0.73) MEN1KMT2ANPC1RAB9ASIGMAR1
SCHEMBL610584 0.70 NPC1 (1.00) MEN1KMT2ANPC1RAB9ASIGMAR1
SCHEMBL39566 0.69 CNR1 (0.34) ALDH1A1CNR1MAPTGAAPOLB
SCHEMBL25001981 0.68 SIGMAR1 (0.50) MEN1KMT2ANPC1RAB9ASIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1317013-B1 NON-AQUEOUS ELECTROLYTE AND SECONDARY CELL USING THE SAME MITSUBISHI CHEM CORP (JP) 2017-03-15 EP disclosed
US-6942948-B2 Nonaqueous electrolyte solution and secondary battery employing the same MITSUBISHI CHEMICAL CORPORATION (JP) 2005-09-13 US disclosed
CN-1215595-C Nonaqueous electrolyte and secondary battery using the same MITSUBISHI CHEM CORP (JP) 2005-08-17 CN disclosed
CN-1465117-A Nonaqueous electrolyte and secondary battery using the same MITSUBISHI CHEM CORP (JP) 2003-12-31 CN disclosed
US-20030165733-A1 Nonaqueous electrolyte solution and secondary battery employing the same MITSUBISHI CHEMICAL CORPORATION (JP) 2003-09-04 US disclosed
EP-1317013-A1 NON-AQUEOUS ELECTROLYTE AND SECONDARY CELL USING THE SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2003-06-04 EP disclosed
EP-0195259-B1 2-Chloro-N-(4,6-dimethoxy-5-pyrimidinyl)-N-[1-(1-pyrazolyl)ethyl]acet-amide, herbicidal composition comprising said compound, and method of controlling weeds using said compound MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1988-12-28 EP disclosed
US-4657579-A HERBICIDE SANDOZ LTD. (CH) 1987-04-14 US disclosed
US-4654074-A 2-chloro-N-(4,6-dimethoxy-5-pyrimidinyl)-N-[1,(1-pyrazolyl)ethyl]acetamide, herbicidal composition comprising said compound, and method of controlling weeds using said compound MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1987-03-31 US disclosed
EP-0195259-A1 2-Chloro-N-(4,6-dimethoxy-5-pyrimidinyl)-N-[1-(1-pyrazolyl)ethyl]acet-amide, herbicidal composition comprising said compound, and method of controlling weeds using said compound MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1986-09-24 EP disclosed