SCHEMBL6680904

SCHEMBL6680904

C=C(C#Cc1ccccc1)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.48
VCP P55072 1/20 0.44
NPSR1 Q6W5P4 4/20 0.44
MAPT P10636 4/20 0.43
HSP90AA1 P07900 4/20 0.40
ALDH1A1 P00352 3/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
HTT P42858 2/20 0.40
MITF O75030 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
OPRK1 P41145 2/20 0.40
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
AGTR1 P30556 1/20 0.39
PAX8 Q06710 1/20 0.39
TLR9 Q9NR96 1/20 0.39
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37

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
SCHEMBL13077423 0.88 APP (0.45) APPVCPMAPTMEN1KMT2A
SCHEMBL9119892 0.83 MAPT (0.42) NPSR1MAPTALDH1A1MEN1KMT2A
SCHEMBL15827905 0.82 APP (0.39) APPVCPNPSR1MAPTHSP90AA1
SCHEMBL29039348 0.82 C1S (0.41) APPVCPNPSR1MAPTHSP90AA1
SCHEMBL7607992 0.81 APP (0.52) APPVCPNPSR1MAPTHSP90AA1
SCHEMBL7607990 0.81 APP (0.52) APPVCPNPSR1MAPTHSP90AA1
SCHEMBL15827915 0.81 GFER (0.45) APPVCPNPSR1MAPTHSP90AA1
SCHEMBL29039498 0.79 CYP2A6 (0.44) VCPALDH1A1MEN1KMT2AHTT
SCHEMBL21387797 0.79 ALDH1A1 (0.70) NPSR1MAPTHSP90AA1ALDH1A1MEN1
SCHEMBL9658068 0.76 APP (0.52) APPVCPNPSR1MAPTHSP90AA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120058650-A Catalytic method for preparing 2-methyl furanacetate compound by photocatalysis 兰州大学 2025-05-30 CN disclosed
CN-118580134-A Preparation method of 1, 3-eneyne GEM isomer 安徽大学 2024-09-03 CN disclosed
CN-113083350-B Preparation method and application of Cu/Al-SBA-15 bimetal composite catalyst 三峡大学 2022-08-05 CN disclosed
CN-113083349-B Preparation method and application of SBA-15 modified by nano Cu simple substance 三峡大学 2022-07-15 CN disclosed
CN-112939004-B Preparation method of Al modified SBA-15 and application of Al modified SBA-15 in catalyzing alkynol dehydration reaction 三峡大学 2022-04-22 CN disclosed
CN-113620762-A Ketene compound and preparation method and application thereof 深圳湾实验室 2021-11-09 CN disclosed
CN-107021866-A A kind of chain yne compounds and its synthetic method 三峡大学 2017-08-08 CN disclosed
EP-1478669-A1 NANOSCALE POLYMERIZED HYDROCARBON PARTICLES AND METHODS OF MAKING AND USING SUCH PARTICLES DOW GLOBAL TECHNOLOGIES INC. (US) 2004-11-24 EP disclosed
US-20040054111-A1 Nanoscale polymerized hydrocarbon particles and methods of making and using such particles KALANTAR THOMAS H (US) 2004-03-18 US disclosed
US-20030162890-A1 Nanoscale polymerized hydrocarbon particles and methods of making and using such particles KALANTAR THOMAS H (US) 2003-08-28 US disclosed
WO-2003070777-A1 NANOSCALE POLYMERIZED HYDROCARBON PARTICLES AND METHODS OF MAKING AND USING SUCH PARTICLES DOW GLOBAL TECHNOLOGIES INC. (US) 2003-08-28 WO disclosed