SCHEMBL181108

SCHEMBL181108

N#CCCc1ccccc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.70
KMT2A Q03164 1/20 0.70
ALDH1A1 P00352 2/20 0.48
HPGD P15428 1/20 0.48
ALOX15 P16050 1/20 0.48
ALOX12 P18054 1/20 0.48
CASP1 P29466 1/20 0.48
HSD17B10 Q99714 1/20 0.48
TDP1 Q9NUW8 2/20 0.46
CYP2A6 P11509 2/20 0.46
HTR2A P28223 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
TAAR1 Q96RJ0 1/20 0.46
LOXL2 Q9Y4K0 1/20 0.46
CYP1A1 P04798 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP1B1 Q16678 1/20 0.44
MAOA P21397 3/20 0.44
MAOB P27338 3/20 0.44
TRPA1 O75762 1/20 0.41

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
Benzene SCHEMBL28469748 1.00 MEN1 (0.70) MEN1KMT2AALDH1A1HPGDALOX15
SCHEMBL13618845 1.00 MEN1 (0.70) MEN1KMT2AALDH1A1HPGDALOX15
SCHEMBL23649359 0.86 MEN1 (0.54) MEN1KMT2ATAAR1NR1H2NR1H3
SCHEMBL8764230 0.86 MEN1 (0.64) MEN1KMT2AALDH1A1HSD17B10TDP1
SCHEMBL4428984 0.85 SIGMAR1 (0.57) MEN1KMT2A
SCHEMBL181369 0.85 MEN1 (0.52) MEN1KMT2AHTR2ASMN1; SMN2MAOA
Phenyl Propionic Acid SCHEMBL6691396 0.84 KEAP1 (0.70) MEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL1162643 0.83 MAOA (0.52) MEN1KMT2AMAOAMAOBMIF
Hydrochloric Acid SCHEMBL9324490 0.83 MEN1 (0.50) MEN1KMT2AHTR2ASMN1; SMN2MAOA
Diethanolamine SCHEMBL11336038 0.82 MEN1 (0.50) MEN1KMT2ATDP1SMN1; SMN2

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 1385 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118995472-B Combined lactobacillus acidophilus capable of metabolizing thioglucoside 西南大学 2025-03-25 CN claimed
US-20240400784-A1 Method for Screening Solvent for Extracting Polyvinyl Chloride, Method for Recycling Waste, Recycled Polyvinyl Chloride, and Composition LG CHEM, LTD. (KR) 2024-12-05 US claimed
US-20240392094-A1 Method for Screening Solvent for Polyvinyl Chloride Extraction, Recycling Method for Waste Material, and Recycled Polyvinyl Chloride and Composition LG CHEM, LTD. (KR) 2024-11-28 US claimed
CN-118995472-A Combined lactobacillus acidophilus capable of metabolizing thioglucoside 西南大学 2024-11-22 CN claimed
CN-115974721-B Method for synthesizing 2-carbonyl substituted nitrile compound through 2, 2-trifluoroethyl ketone 平顶山学院 2024-07-02 CN claimed
CN-117897439-A Method for screening solvent for extraction of polyvinyl chloride, method for recovering waste material, and recovered polyvinyl chloride and composition 株式会社LG化学 2024-04-16 CN claimed
CN-117897440-A Method for screening solvent for extraction of polyvinyl chloride, method for recycling waste material, recycled polyvinyl chloride and composition 株式会社LG化学 2024-04-16 CN claimed
WO-2023214119-A1 AZETIDINE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS THEREOF, PREPARATION METHODS AND THEIR USES IN THE TREATMENT OF CNS DISORDERS EQUINORM LTD (FI) 2023-11-09 WO claimed
WO-2023171591-A1 PRODUCTION METHOD FOR EPISULFIDE COMPOUND 三菱瓦斯化学株式会社 2023-09-14 WO claimed
CN-114409571-B Synthesis method of nitrile compound 重庆医科大学 2023-05-12 CN claimed
EP-0757558-A1 SCREENING METHODS FOR INTEGUMENTAL INFLAMMATION MODULATING AGENTS ALZA CORPORATION (US) 1997-02-12 EP claimed
WO-1995027510-A1 SCREENING METHODS FOR INTEGUMENTAL INFLAMMATION MODULATING AGENTS ALZA CORPORATION (US) 1995-10-19 WO claimed
EP-0628848-A1 ELECTROCHROMIC DEVICE Tonen Corporation (JP) 1994-12-14 EP claimed
EP-0245417-B1 NEW PROCESS FOR OBTAINING ALPHA-AMINO NITRILES AND THEIR APPLICATIONS TO ORGANIC SYNTHESIS Albert ROLLAND S.A. Société dite (FR) 1992-03-04 EP claimed
EP-0192492-B1 PEPTIDES CONTAINING AN ALIPHATIC-AROMATIC KETONE SIDE CHAIN THE SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 1992-01-02 EP claimed
US-4880624-A GUAIACOL, TRIMETHOXYBENZENE THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 1989-11-14 US claimed
US-4453973-A 3-(CARBAMOYLOXY)-ANILIDES SCHERING AKTIENGESELLSCHAFT (DE) 1984-06-12 US claimed
US-4017631-A MICROBIOCIDES JANSSEN PHARMACEUTICA N.V. (BE) 1977-04-12 US claimed
US-3991202-A ANTIMICROBIALS JANSSEN PHARMACEUTICA N.V. (BE) 1976-11-09 US claimed
US-3969374-A Process for preparing amino-anthraquinones BAYER AKTIENGESELLSCHAFT (DT) 1976-07-13 US claimed