SCHEMBL377133

SCHEMBL377133

[c]1occc1-c1cccs1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.39
ALDH1A1 P00352 4/20 0.39
HPGD P15428 3/20 0.39
MEN1 O00255 2/20 0.39
MAPT P10636 2/20 0.39
KMT2A Q03164 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
LTA4H P09960 2/20 0.37
DPP4 P27487 3/20 0.36
HSD17B10 Q99714 3/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CYP3A4 P08684 2/20 0.35
CYP2C9 P11712 2/20 0.35
CYP2E1 P05181 1/20 0.35
CYP2A6 P11509 1/20 0.35
CYP2B6 P20813 1/20 0.35
TDO2 P48775 1/20 0.35

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
Bromide SCHEMBL29519314 0.72 L3MBTL1 (0.55) KDM4EALDH1A1HPGDMEN1MAPT
Bromide SCHEMBL30467088 0.72 L3MBTL1 (0.55) KDM4EALDH1A1HPGDMEN1MAPT
SCHEMBL5348133 0.72
SCHEMBL18050291 0.69 DYRK1A (0.33)
SCHEMBL3545 0.69 L3MBTL1 (0.57) KDM4EALDH1A1HPGDMEN1MAPT
SCHEMBL16291133 0.69 L3MBTL1 (0.57) KDM4EALDH1A1HPGDMEN1MAPT
SCHEMBL4003156 0.68 ALDH1A1 (0.39) KDM4EALDH1A1HPGDMEN1MAPT
Ammonia Solution, Strong SCHEMBL34467257 0.67 L3MBTL1 (0.55) KDM4EALDH1A1HPGDMEN1MAPT
Hydrogen Sulfide SCHEMBL22588115 0.67 L3MBTL1 (0.55) KDM4EALDH1A1HPGDMEN1MAPT
Benzene SCHEMBL29089513 0.67 L3MBTL1 (0.55) KDM4EALDH1A1HPGDMEN1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116354806-A Phosphine catalysis preparation method of full-carbon quaternary carbon cyclopentenone derivative 武汉理工大学 2023-06-30 CN claimed
WO-2023094828-A1 ANTAGONISTS OF CAV 2.3 LARIO THERAPEUTICS LIMITED (GB) 2023-06-01 WO claimed
CN-110511189-A 5- amino -1,2,4- furodiazole derivative and its synthetic method UNIV GUANGXI SCI & TECHNOLOGY 2019-11-29 CN claimed
CN-105810838-A Organic light-emitting device 三星显示有限公司 2016-07-27 CN claimed
CN-105810837-A Organic light-emitting device 三星显示有限公司 2016-07-27 CN claimed
CN-105777558-A Compound, organic light-emitting device including the same, and flat-panel display 三星显示有限公司 2016-07-20 CN claimed
US-8247409-B2 Thieno-[2,3-d]pyrimidine and thieno-pyridazine compounds and methods of use AMGEN INC. (US) 2012-08-21 US claimed
EP-2468285-A1 Macrocyclic hepatitis C serine protease inhibitors Enanta Pharmaceuticals, Inc. (US) 2012-06-27 EP claimed
EP-2378880-A1 USE OF 5-PYRIDIN-4YL(1,3)THIAZOLE FOR TREATING PHYTOPATHOGENIC FUNGI BAYER CROPSCIENCE AG (DE) 2011-10-26 EP claimed
WO-2010069494-A1 USE OF 5-PYRIDIN-4YL(1,3)THIAZOLE FOR TREATING PHYTOPATHOGENIC FUNGI BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2010-06-24 WO claimed
WO-1997019053-A1 METALLOPROTEINASE INHIBITORS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1997-05-29 WO claimed
CN-1131153-A 1-oxy-2-(phenylsulfonamido-) amyl piperidine derivant, its preparation method and medicinal use thereof SYNTHELABO (FR) 1996-09-18 CN claimed
EP-0414299-B1 Biocidal azoxime compounds SHELL INT RESEARCH (NL) 1994-06-15 EP claimed
EP-0281943-B1 Substituted pyridine-2,4-carboxylic acid derivatives, process for their preparation, their use as well as medicaments based on these compounds HOECHST AG (DE) 1994-01-12 EP claimed
EP-0231996-B1 NOVEL AMINO ACID DERIVATIVES NOVO NORDISK A/S (DK) 1993-10-06 EP claimed
WO-1989012688-A1 PROCESS FOR SYNTHESISING L-ALPHA-AMINE OR L-ALPHA-AMINO-N-HYDROXYL ACIDS BY MEANS OF ENZYMES ECOLE NATIONALE SUPERIEURE DE CHIMIE (FR) 1989-12-28 WO claimed
EP-0088276-B1 COMPOUNDS, PROCESS FOR THEIR PREPARATION AND THEIR USE AS PHARMACEUTICAL PREPARATIONS BAYER AG (DE) 1986-04-30 EP claimed
EP-0075167-A2 N-(1-alkenyl)-carboxanilides, process for their preparation and their use as fungicides BAYER AG (DE) 1983-03-30 EP claimed
US-4237298-A Aromatic acetic acid derivatives having sulfur atom at alpha-position and process for their preparation SAGAMI CHEMICAL RESEARCH CENTER (JP) 1980-12-02 US claimed
US-4028354-A BACTERICIDES E. R. SQUIBB & SONS, INC. (US) 1977-06-07 US claimed