SCHEMBL6296126

SCHEMBL6296126

CCCCCCCCCCCCc1n(C)cc[n+]1C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 7/20 0.43
RAB9A P51151 7/20 0.43
HTT P42858 7/20 0.43
SMN1; SMN2 Q16637 4/20 0.43
MAPK1 P28482 3/20 0.43
NPSR1 Q6W5P4 3/20 0.43
MAPT P10636 3/20 0.43
HSP90AA1 P07900 2/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
APAF1 O14727 1/20 0.43
PLA2G1B P04054 1/20 0.43
ATG4B Q9Y4P1 1/20 0.43
HDAC8 Q9BY41 4/20 0.41
APOBEC3A P31941 4/20 0.40
APOBEC3G Q9HC16 4/20 0.40
KDM4E B2RXH2 2/20 0.40
KCNH2 Q12809 1/20 0.39
POLB P06746 3/20 0.38
CTDSP1 Q9GZU7 1/20 0.38

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
SCHEMBL1831748 1.00 NPC1 (0.43) NPC1RAB9AHTTSMN1; SMN2MAPK1
SCHEMBL1832602 1.00 NPC1 (0.43) NPC1RAB9AHTTSMN1; SMN2MAPK1
SCHEMBL30645316 1.00 NPC1 (0.43) NPC1RAB9AHTTSMN1; SMN2MAPK1
SCHEMBL20787057 1.00 NPC1 (0.43) NPC1RAB9AHTTSMN1; SMN2MAPK1
SCHEMBL1835103 1.00 NPC1 (0.43) NPC1RAB9AHTTSMN1; SMN2MAPK1
SCHEMBL29048074 1.00 NPC1 (0.43) NPC1RAB9AHTTSMN1; SMN2MAPK1
Iodide SCHEMBL7631936 0.98 NPC1 (0.42) NPC1RAB9AHTTSMN1; SMN2MAPK1
Iodide SCHEMBL7626653 0.98 NPC1 (0.42) NPC1RAB9AHTTSMN1; SMN2MAPK1
Hydrochloric Acid SCHEMBL7626321 0.98 NPC1 (0.42) NPC1RAB9AHTTSMN1; SMN2MAPK1
Iodide SCHEMBL7626482 0.98 NPC1 (0.42) NPC1RAB9AHTTSMN1; SMN2MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113574031-B Method for reducing or avoiding alkali-aggregate reactions in set concrete 瓦克化学股份公司 2023-09-05 CN disclosed
US-6839222-B2 Electrolytic capacitor MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 2005-01-04 US disclosed
US-20040141281-A1 Electrolytic capacitor MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 2004-07-22 US disclosed