SCHEMBL24938735

SCHEMBL24938735

CCCCCCCCN1C=CC(=C2C=CN(CCCCCCCC)C=C2)C=C1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 9/20 0.60
RAB9A P51151 9/20 0.60
MITF O75030 2/20 0.60
GAA P10253 2/20 0.60
L3MBTL1 Q9Y468 1/20 0.60
SMN1; SMN2 Q16637 6/20 0.57
MAPT P10636 5/20 0.57
MEN1 O00255 4/20 0.57
KMT2A Q03164 4/20 0.57
ALDH1A1 P00352 4/20 0.57
PKM P14618 2/20 0.50
RECQL P46063 1/20 0.50
PTGS1 P23219 3/20 0.47
PTGS2 P35354 3/20 0.47
MGLL Q99685 3/20 0.47
FAAH O00519 1/20 0.47
TP53 P04637 1/20 0.41
MAPK10 P53779 1/20 0.41
LMNA P02545 3/20 0.40
POLB P06746 3/20 0.40

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
SCHEMBL17598817 1.00 NPC1 (0.60) NPC1RAB9AMITFGAAL3MBTL1
SCHEMBL11291375 1.00 NPC1 (0.60) NPC1RAB9AMITFGAAL3MBTL1
Bromide SCHEMBL29786703 0.98 NPC1 (0.58) NPC1RAB9AMITFGAAL3MBTL1
Bromide SCHEMBL30020235 0.98 NPC1 (0.58) NPC1RAB9AMITFGAAL3MBTL1
Bromide SCHEMBL31435799 0.98 NPC1 (0.58) NPC1RAB9AMITFGAAL3MBTL1
Hydrochloric Acid SCHEMBL29937101 0.98 NPC1 (0.58) NPC1RAB9AMITFGAAL3MBTL1
Bromide SCHEMBL29463912 0.98 NPC1 (0.58) NPC1RAB9AMITFGAAL3MBTL1
Bromide SCHEMBL30021026 0.98 NPC1 (0.58) NPC1RAB9AMITFGAAL3MBTL1
SCHEMBL11498765 0.98 NPC1 (0.59) NPC1RAB9AMITFGAAL3MBTL1
SCHEMBL17598805 0.94 NPC1 (0.55) NPC1RAB9AMITFGAAL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230022263-A1 N-TYPE DOPANTS FOR PHOTOACTIVE REGIONS OF ORGANIC PHOTOVOLTAICS UNIV KING ABDULLAH SCI & TECH (SA) 2023-01-26 US disclosed
CN-110642778-B Viologen compound, preparation method and application thereof 淮阴师范学院 2022-10-04 CN disclosed