SCHEMBL6362006

SCHEMBL6362006

O=C1CCN(c2ccccc2)CN1c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
KMT2A Q03164 2/20 0.50
MEN1 O00255 1/20 0.50
DDB1 Q16531 1/20 0.46
CRBN Q96SW2 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
NPSR1 Q6W5P4 1/20 0.44
KDM4E B2RXH2 1/20 0.42
GAA P10253 1/20 0.42
MAPT P10636 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
SIGMAR1 Q99720 2/20 0.41
ALDH1A1 P00352 2/20 0.40
HTR3E A5X5Y0 1/20 0.39
HTR3B O95264 1/20 0.39
ADRB1 P08588 1/20 0.39
HTR3A P46098 1/20 0.39
HTR3D Q70Z44 1/20 0.39
HTR3C Q8WXA8 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
SCHEMBL136822 0.81 NPC1 (0.60) NPC1RAB9AKMT2AMEN1DDB1
SCHEMBL6366167 0.80 MAPT (0.48) NPC1RAB9AKMT2AMEN1DDB1
SCHEMBL6401673 0.79 MEN1 (0.39) NPC1RAB9AKMT2AMEN1DDB1
SCHEMBL6363233 0.79 SRD5A1 (0.41) NPC1RAB9AKMT2AMEN1SIGMAR1
SCHEMBL6366644 0.79 NPC1 (0.48) NPC1RAB9AKMT2AMEN1DDB1
SCHEMBL14597188 0.74 MEN1 (0.50) NPC1RAB9AKMT2AMEN1L3MBTL1
SCHEMBL136476 0.74 ALDH1A1 (0.67) NPC1RAB9AKMT2AMEN1DDB1
Naphthalene SCHEMBL9819365 0.73 MEN1 (0.36) NPC1RAB9AKMT2AMEN1DDB1
SCHEMBL14597190 0.73 KMT2A (0.50) NPC1RAB9AKMT2AMEN1GAA
SCHEMBL532107 0.73 LMNA (0.52) NPC1RAB9AKMT2AMEN1NPSR1

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