SCHEMBL3225575

SCHEMBL3225575

S=C=Nc1ccc2ccccc2c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MIF P14174 1/20 0.54
MEN1 O00255 6/20 0.52
NPC1 O15118 6/20 0.52
RAB9A P51151 6/20 0.52
KMT2A Q03164 6/20 0.52
HSP90AA1 P07900 3/20 0.52
HTR3E A5X5Y0 2/20 0.48
HTR3B O95264 2/20 0.48
HTR3A P46098 2/20 0.48
HTR3D Q70Z44 2/20 0.48
HTR3C Q8WXA8 2/20 0.48
CYP1A2 P05177 3/20 0.44
ALDH1A1 P00352 3/20 0.44
TDP1 Q9NUW8 3/20 0.44
CYP3A4 P08684 2/20 0.44
HPGD P15428 2/20 0.44
HSD17B10 Q99714 2/20 0.44
ABCB11 O95342 1/20 0.44
NR3C1 P04150 1/20 0.44
ADRA2A P08913 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
SCHEMBL8132397 0.94 MIF (0.52) MIFMEN1NPC1RAB9AKMT2A
SCHEMBL381627 0.82 MEN1 (0.55) MEN1NPC1RAB9AKMT2AHSP90AA1
SCHEMBL29355266 0.82 MEN1 (0.55) MEN1NPC1RAB9AKMT2AHSP90AA1
Naphthalene SCHEMBL28447003 0.79 MIF (0.85) MIFMEN1KMT2ACYP1A2ALDH1A1
SCHEMBL3283287 0.79 MEN1 (0.75) MEN1NPC1RAB9AKMT2AHSP90AA1
SCHEMBL10017620 0.79 MEN1 (0.75) MEN1NPC1RAB9AKMT2AHSP90AA1
SCHEMBL31682271 0.78 MEN1 (0.52) MEN1NPC1RAB9AKMT2AHSP90AA1
SCHEMBL407338 0.78 MEN1 (0.52) MEN1NPC1RAB9AKMT2AHSP90AA1
SCHEMBL12475893 0.78 MEN1 (0.52) MEN1NPC1RAB9AKMT2AHSP90AA1
SCHEMBL11721025 0.78 CYP2A6 (0.43) MIFMEN1NPC1RAB9AKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116987036-A Synthesis method of base-promoted 4-cyanoimidazole derivative 曲阜师范大学 2023-11-03 CN claimed
CN-111793041-B Photocatalytic synthesis method of N-aryl naphtho [2,1-d ] thiazole-2-amine 湖南科技学院 2023-02-24 CN claimed
CN-111559989-B Synthesis method and application of visible light-promoted 2-aminonaphtho [2,1-d ] thiazole compound 青岛科技大学 2022-09-09 CN claimed
CN-111875563-B Synthesis method of N, N-disubstituted naphtho [2,1-d ] thiazole-2-amine compound 湖南科技学院 2022-06-28 CN claimed
CN-114516848-A Preparation method of polycarbonate high-temperature degradation resistant agent and polycarbonate composition 万华化学集团股份有限公司 2022-05-20 CN claimed
CN-111777574-B Synthesis method of N-alkyl naphtho [2,1-d ] thiazole-2-amine promoted by visible light 湖南科技学院 2022-05-10 CN claimed
US-20210372959-A1 Nanopore Method for Identifying Single Amino Acid in Oligopeptides UNIVERSITY OF SOUTH CAROLINA (US) 2021-12-02 US claimed
CN-111875563-A Synthesis method of N, N-disubstituted naphtho [2,1-d ] thiazole-2-amine compound 湖南科技学院 2020-11-03 CN claimed
CN-111793041-A Photocatalytic synthesis method of N-aryl naphtho [2,1-d ] thiazole-2-amine 湖南科技学院 2020-10-20 CN claimed
CN-111777574-A Synthesis method of N-alkyl naphtho [2,1-d ] thiazole-2-amine promoted by visible light 湖南科技学院 2020-10-16 CN claimed
CN-111559989-A Synthesis method and application of visible light-promoted 2-aminonaphtho [2,1-d ] thiazole compound 青岛科技大学 2020-08-21 CN claimed
CN-109265382-A A kind of fluorine-containing thiocarbamates compound and its synthetic method 湖北科技学院 2019-01-25 CN claimed
CN-107188866-A A kind of synthetic method of the ketone compounds of polysubstituted thiazole 4 湖北科技学院 2017-09-22 CN claimed
CN-106966990-A A kind of synthetic method of the polysubstituted ketone compounds of 2 thiocarbamoyl imidazole quinoline 4 湖北科技学院 2017-07-21 CN claimed
WO-2024163166-A1 BORON CONTAINING COMPOUNDS AND THEIR USES 5METIS, INC. (US) 2024-08-08 WO disclosed
CN-116082195-B Pleuromutilin urea compounds, and preparation method and application thereof 中国医学科学院药物研究所 2024-03-26 CN disclosed
CN-116987036-A Synthesis method of base-promoted 4-cyanoimidazole derivative 曲阜师范大学 2023-11-03 CN disclosed
US-4153416-A Process and apparatus for pulse labelling protein material in the Edman degradation process HEWLETT-PACKARD COMPANY, 3000 HANOVER ST., PALO ALTO, CA A CORP. OF CA 1979-05-08 US disclosed
US-4073767-A Hydrogen phosphonates and polymers containing them as flame retardants MONSANTO COMPANY (US) 1978-02-14 US disclosed
US-4008326-A INCREASING PRODUCTION OF PROSTAGLANDINS THE UPJOHN COMPANY (US) 1977-02-15 US disclosed