SCHEMBL6366644

SCHEMBL6366644

CN1CCC(=O)N(c2ccccc2)C1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
DDB1 Q16531 1/20 0.44
CRBN Q96SW2 1/20 0.44
SIGMAR1 Q99720 1/20 0.44
HSD11B1 P28845 1/20 0.41
SLC6A2 P23975 1/20 0.40
CACNA2D1 P54289 1/20 0.40
ALDH1A1 P00352 2/20 0.40
USP2 O75604 1/20 0.40
POLB P06746 1/20 0.40
MAPT P10636 1/20 0.40
HPGD P15428 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 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
SCHEMBL6365924 0.81 NPC1 (0.47) NPC1RAB9AMEN1KMT2ADDB1
SCHEMBL136822 0.80 NPC1 (0.60) NPC1RAB9AMEN1KMT2ADDB1
SCHEMBL6362006 0.79 NPC1 (0.50) NPC1RAB9AMEN1KMT2ADDB1
SCHEMBL20095543 0.75 SIGMAR1 (0.55) NPC1RAB9AMEN1KMT2ADDB1
SCHEMBL6418503 0.74 MEN1 (0.59) NPC1RAB9AMEN1KMT2ADDB1
Methylpyrrolidone SCHEMBL28278382 0.74 BRD4 (0.57) NPC1RAB9AMEN1KMT2ADDB1
SCHEMBL14597188 0.73 MEN1 (0.50) NPC1RAB9AMEN1KMT2ASIGMAR1
SCHEMBL136476 0.72 ALDH1A1 (0.67) NPC1RAB9AMEN1KMT2ADDB1
SCHEMBL156594 0.72 NPC1 (0.55) NPC1RAB9AMEN1KMT2ADDB1
SCHEMBL4420931 0.71 DDB1 (0.46) NPC1RAB9AMEN1KMT2ADDB1

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 4 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
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