SCHEMBL651586

SCHEMBL651586

Brc1ccc(C#Cc2ccccc2)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.67
MAPT P10636 2/20 0.56
ALDH1A1 P00352 4/20 0.53
TDP1 Q9NUW8 1/20 0.53
MAPK1 P28482 1/20 0.50
PYCR1 P32322 1/20 0.47
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA9 Q16790 1/20 0.46
GRM5 P41594 1/20 0.46
FFAR1 O14842 4/20 0.45
KDM4E B2RXH2 2/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
CYP1A2 P05177 2/20 0.44
CYP3A4 P08684 2/20 0.44
CYP2C9 P11712 2/20 0.44
CYP2C19 P33261 2/20 0.44
NPC1 O15118 1/20 0.44

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
SCHEMBL5401236 1.00 APP (0.67) APPMAPTALDH1A1TDP1MAPK1
Diphenylacetylene SCHEMBL28746878 0.92 APP (0.71) APPMAPTALDH1A1TDP1MAPK1
SCHEMBL20015760 0.88 CYP2A6 (0.57) APPMAPTALDH1A1TDP1MAPK1
SCHEMBL1246271 0.88 CYP2A6 (0.57) APPMAPTALDH1A1TDP1MAPK1
SCHEMBL30822820 0.87 APP (0.50) APPMAPTALDH1A1TDP1MAPK1
SCHEMBL2114741 0.85 APP (0.92) APPMAPTALDH1A1CA12CA1
Diphenylacetylene SCHEMBL960609 0.82 APP (1.00) APPMAPTALDH1A1CA12CA1
Diphenylacetylene SCHEMBL29188592 0.82 APP (1.00) APPMAPTALDH1A1CA12CA1
Diphenylacetylene SCHEMBL68254 0.82 APP (1.00) APPMAPTALDH1A1CA12CA1
SCHEMBL387788 0.80 APP (0.42) APPMAPTALDH1A1TDP1MAPK1

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 165 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4554797-A1 ANTI-COUNTERFEITING LABEL FOR THE AUTHENTICATION OF GOODS Politecnico di Milano (IT) 2025-05-21 EP claimed
CN-117843539-A Novel space conjugated organic molecule based on hexaphenyl benzene anchoring group and preparation and application thereof 桂林理工大学 2024-04-09 CN claimed
CN-115337945-B Photocatalyst, preparation method thereof and application of photocatalyst in preparation of olefin compounds 中国科学院化学研究所 2024-02-20 CN claimed
CN-114736228-B Fluorescence sensing film based on pyromellitic acid diimide derivative modified by o-carborane, preparation method and application 陕西师范大学 2024-01-30 CN claimed
WO-2024013693-A1 ANTI-COUNTERFEITING LABEL FOR THE AUTHENTICATION OF GOODS POLITECNICO DI MILANO (IT) 2024-01-18 WO claimed
CN-115337945-A Photocatalyst, preparation method thereof and application of photocatalyst in preparation of olefin compounds 中国科学院化学研究所 2022-11-15 CN claimed
CN-114736228-A O-carborane modified pyromellitic acid diimide derivative-based fluorescent sensing film, and preparation method and application thereof 陕西师范大学 2022-07-12 CN claimed
CN-102276414-B Star-shaped tetraarylethene compound and preparation method and application thereof CHINESE ACAD TECH INST PHYSICS 2013-06-26 CN claimed
CN-102276414-A Star-shaped tetraarylethene compound and preparation method and application thereof 2011-12-14 CN claimed
CN-119409981-A Cadmium coordination polymer capable of regulating and controlling photo-stimulus response behavior through thermal phase change, and preparation method and application thereof 广西民族大学 2025-02-11 CN disclosed
CN-116408123-B Carbon nitride-based nickel monoatomic photocatalytic material and preparation method and application thereof 中国科学院化学研究所 2025-01-14 CN disclosed
CN-115337945-B Photocatalyst, preparation method thereof and application of photocatalyst in preparation of olefin compounds 中国科学院化学研究所 2024-02-20 CN disclosed
CN-114736228-B Fluorescence sensing film based on pyromellitic acid diimide derivative modified by o-carborane, preparation method and application 陕西师范大学 2024-01-30 CN disclosed
WO-2023140012-A1 COMPOUND, LIGHT ABSORPTION MATERIAL, NON-LINEAR LIGHT ABSORPTION MATERIAL, RECORDING MEDIUM, INFORMATION RECORDING METHOD, AND INFORMATION READ-OUT METHOD パナソニックIPマネジメント株式会社 2023-07-27 WO disclosed
EP-0596057-B1 QUINUCLIDINE DERIVATIVES AS SQUALENE SYNTHASE INHIBITORS ZENECA LTD (GB) 1998-09-09 EP disclosed
EP-0597701-B1 Conjugated enyne derivative and liquid crystal composition CHISSO CORP (JP) 1997-04-16 EP disclosed
US-5370819-A Low viscosity CHISSO CORPORATION (JP) 1994-12-06 US disclosed
EP-0597701-A1 Conjugated enyne derivative and liquid crystal composition CHISSO CORPORATION (JP) 1994-05-18 EP disclosed
EP-0596057-A1 QUINUCLIDINE DERIVATIVES AS SQUALENE SYNTHASE INHIBITORS ZENECA LIMITED (GB) 1994-05-11 EP disclosed
WO-1993021183-A1 QUINUCLIDINE DERIVATIVES AS SQUALENE SYNTHASE INHIBITORS ZENECA LIMITED (GB) 1993-10-28 WO disclosed