SCHEMBL44284

SCHEMBL44284

c1ccc(-n2cccc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.50
MAPT P10636 2/20 0.50
GAA P10253 2/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
VHL P40337 1/20 0.50
ELOC Q15369 1/20 0.50
ELOB Q15370 1/20 0.50
CYP3A4 P08684 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
POLB P06746 3/20 0.48
NSD2 O96028 1/20 0.48
GRK2 P25098 1/20 0.48
CASP6 P55212 1/20 0.48
CTDSP1 Q9GZU7 1/20 0.48
HPGD P15428 2/20 0.47
PKM P14618 1/20 0.47
ALDH1A1 P00352 3/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
NPC1 O15118 2/20 0.46

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
SCHEMBL28804090 0.84 KDM4E (0.40) KDM4EMAPTGAAL3MBTL1VHL
Guanidine SCHEMBL4169570 0.84 MAPT (0.45) KDM4EMAPTGAAL3MBTL1VHL
Acetic Acid SCHEMBL4493022 0.84 POLB (0.53) KDM4EMAPTGAAL3MBTL1VHL
SCHEMBL6632881 0.83 MEN1 (0.57) KDM4EMAPTGAAL3MBTL1VHL
SCHEMBL29093319 0.79 AOC2 (0.47) KDM4EMAPTGAAL3MBTL1VHL
Benzamide SCHEMBL17338675 0.78 POLB (0.64) KDM4EMAPTL3MBTL1CYP3A4POLB
SCHEMBL20319187 0.78 MAPT (0.68) KDM4EMAPTGAAL3MBTL1VHL
SCHEMBL7847141 0.77 ALDH1A1 (0.55) KDM4EMAPTGAAL3MBTL1VHL
SCHEMBL7013183 0.77 LTA4H (0.55) KDM4EGAAL3MBTL1VHLELOC
SCHEMBL402534 0.77 APP (0.55) KDM4EMAPTGAAL3MBTL1VHL

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

Appears in 14965 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250351825-A1 AGRICULTURAL COMPOSITIONS FOR PROTECTING PLANTS AGAINST ABIOTIC STRESSORS SPOGEN BIOTECH INC (US) 2025-11-20 US claimed
EP-4649827-A2 FUNGICIDAL MIXTURES ADAMA MAKHTESHIM LTD. (IL) 2025-11-19 EP claimed
EP-4637347-A1 OIL FLOWABLE APYRASE INHIBITOR FORMULATION Texas Crop Science, Inc. (US) 2025-10-29 EP claimed
US-20250302040-A1 FUNGICIDAL COMBINATIONS OF FLUAZINAM AND USES THEREOF ADAMA MAKHTESHIM LTD. (IL) 2025-10-02 US claimed
EP-4618758-A1 MIXTURES OF SUCCINATE DEHYDROGENASE INHIBITORS AND PICOLINAMIDES FMC Corporation (US) 2025-09-24 EP claimed
US-20250287934-A1 METHOD OF FUNGICIDAL TREATMENT TO HARVESTED CROPS SYNGENTA CROP PROTECTION AG (CH) 2025-09-18 US claimed
EP-4608136-A1 WATER DISPERSIBLE GRANULE ACYLHYDRAZONE APYRASE INHIBITOR FORMULATION Texas Crop Science, Inc. (US) 2025-09-03 EP claimed
EP-4604724-A1 SUSPENSION CONCENTRATE ACYLHYDRAZONE APYRASE INHIBITOR FORMULATION Texas Crop Science, Inc. (US) 2025-08-27 EP claimed
CN-120166922-A Apyrase inhibitors 德州作物科学股份有限公司 2025-06-17 CN claimed
US-20250185655-A1 PHEROMONE COMPOSITIONS, METHODS OF MAKING, AND THEIR USES PHERONYM INC. (US) 2025-06-12 US claimed
EP-0271541-A1 TREATMENT OF MERCAPTAN-CONTAINING STREAMS UTILIZING NITROGEN BASED PROMOTERS MERICHEM COMPANY (US) 1988-06-22 EP claimed
WO-1987007904-A1 TREATMENT OF MERCAPTAN-CONTAINING STREAMS UTILIZING NITROGEN BASED PROMOTERS MERICHEM COMPANY (US) 1987-12-30 WO claimed
WO-1987006132-A1 ANTHELMINTIC QUATERNARYALKYL ACYLHYDRAZONES, METHOD OF USE AND COMPOSITIONS THE UPJOHN COMPANY (US) 1987-10-22 WO claimed
US-4675186-A 6-(1-acyl-1-hydroxymethyl)penicillanic acid derivatives PFIZER INC. (US) 1987-06-23 US claimed
US-4650558-A Semiconductor electrode with improved photostability characteristics THE UNITED STATES OF AMERICA AS REPRESENTED BY THE UNITED STATES DEPARTMENT OF ENERGY (US) 1987-03-17 US claimed
EP-0201221-A1 6-(1-acyl-1-hydroxy methyl) penicillanic acid derivatives PFIZER INC. (US) 1986-11-12 EP claimed
US-4571029-A Electro-optical switching and memory display device THE UNITED STATES OF AMERICA AS REPRESENTED BY THE UNITED STATES DEPARTMENT OF ENERGY (US) 1986-02-18 US claimed
EP-0171037-A2 3-Carbonyl-1-aminoalkyl-1H-indoles useful as analgesics and preparation thereof STERLING WINTHROP INC. (US) 1986-02-12 EP claimed
US-4552927-A POLYMERIC ANION ROCKWELL INTERNATIONAL CORPORATION (US) 1985-11-12 US claimed
EP-0007605-B1 A PROCESS FOR INVERTING THE CONFIGURATION IN OPTICALLY ACTIVE COMPOUNDS AND OPTICALLY ACTIVE INTERMEDIATE COMPOUNDS AND THEIR SALTS REQUIRED THEREFOR CIBA-GEIGY AG (CH) 1982-09-15 EP claimed