SCHEMBL44479

SCHEMBL44479

CN(C)C(=[O+]n1nnc2ccccc21)N(C)C.F[B-](F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 6/20 0.41
POLB P06746 2/20 0.41
MAPK1 P28482 1/20 0.41
ATM Q13315 1/20 0.41
KEAP1 Q14145 1/20 0.41
MAPT P10636 3/20 0.39
KMT2A Q03164 3/20 0.39
ALDH1A1 P00352 2/20 0.39
KDM4E B2RXH2 1/20 0.39
HTT P42858 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
DGAT1 O75907 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
THPO P40225 1/20 0.38
CYP4Z1 Q86W10 1/20 0.38
KCNMA1 Q12791 2/20 0.36
MGAM O43451 4/20 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
SCHEMBL2824611 1.00 SLC9A1 (0.41) SLC9A1POLBMAPK1ATMKEAP1
SCHEMBL1941412 1.00 SLC9A1 (0.41) SLC9A1POLBMAPK1ATMKEAP1
SCHEMBL5332213 0.99 SLC9A1 (0.40) SLC9A1POLBMAPK1ATMKEAP1
SCHEMBL78773 0.94 SLC9A1 (0.46) SLC9A1POLBMAPK1ATMKEAP1
SCHEMBL30378712 0.94 SLC9A1 (0.46) SLC9A1POLBMAPK1ATMKEAP1
SCHEMBL1395480 0.93 POLB (0.54) SLC9A1POLBMAPK1ATMKEAP1
Bromide SCHEMBL5514455 0.92 SLC9A1 (0.44) SLC9A1POLBMAPK1ATMKEAP1
SCHEMBL5090298 0.92 SLC9A1 (0.44) SLC9A1POLBMAPK1ATMKEAP1
SCHEMBL1462681 0.92 SLC9A1 (0.44) SLC9A1POLBMAPK1ATMKEAP1
SCHEMBL5600925 0.91 SLC9A1 (0.41) SLC9A1POLBMAPK1ATMKEAP1

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 16638 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12508321-B2 Conjugation linkers, cell binding molecule-drug conjugates containing the linkers, methods of making and uses such conjugates with the linkers HANGZHOU DAC BIOTECH CO., LTD. (CN) 2025-12-30 US claimed
US-12509426-B1 Carbon-14 radioisotope-labeled flonicamid and synthesis method thereof Zhejiang Isotope Labelled Compounds Co., Ltd (CN) 2025-12-30 US claimed
US-12496351-B2 Conjugation linkers, cell binding molecule-drug conjugates containing the linkers, methods of making and uses such conjugates with the linkers HANGZHOU DAC BIOTECH CO., LTD. (CN) 2025-12-16 US claimed
US-20250376449-A1 PREPARATION PROCESS FOR JAKTINIB DIHYDROCHLORIDE MONOHYDRATE SUZHOU ZELGEN BIOPHARMACEUTICALS CO LTD (CN) 2025-12-11 US claimed
US-12486286-B2 Process and polymorphic forms of bictegravir and its pharmaceutically acceptable salts or co-crystals thereof LAURUS LABS LIMITED (IN) 2025-12-02 US claimed
US-12473265-B2 Methods for preparing PSMA conjugates ENDOCYTE, INC. (US) 2025-11-18 US claimed
US-20250326798-A1 Synthetic Process for Production of Modified GCC Receptor Agonists IRONWOOD PHARMACEUTICALS INC (US) 2025-10-23 US claimed
US-20250313609-A1 Polypeptide Fragment Thyroid Hormone Receptor BETA1 (THRB)-CVD20, and Polyclonal Antibody Prepared Using the Same and Use Thereof BEIJING BIOSYNTHESIS BIOTECHNOLOGY CO., LTD. (CN) 2025-10-09 US claimed
EP-4628492-A1 PREPARATION METHOD FOR LINKER-DRUG CONJUGATE AND INTERMEDIATE THEREOF Shanghai Fudan-Zhangjiang Bio-Pharmaceutical Co., Ltd. (CN) 2025-10-08 EP claimed
US-12398114-B2 Process for the preparation of ELIGLUSTAT and its intermediate PIRAMAL PHARMA LIMITED (IN) 2025-08-26 US claimed
WO-2000001711-A1 REUSABLE SOLID SUPPORT FOR OLIGONUCLEOTIDE SYNTHESIS UNIVERSITY TECHNOLOGIES INTERNATIONAL INC. (CA) 2000-01-13 WO claimed
US-5916888-A Imidazo 1,5A!pyridine derived serine protease inhibitors AKZO NOBEL, N.V. (NL) 1999-06-29 US claimed
EP-0906296-A1 PROCESS FOR THE PREPARATION OF CHIRAL KETO-HETEROCYCLES OF BASIC AMINO ACIDS WARNER-LAMBERT COMPANY LLC (US) 1999-04-07 EP claimed
EP-0899267-A1 Disubstituted trans-3,4,4a,5,6,10b-hexahydro-2H-napht(1,2-b)-1,4-oxazines, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1999-03-03 EP claimed
EP-0877751-A1 LINKER ARM FOR SOLID SUPPORT OLIGONUCLEOTIDE SYNTHESIS AND PROCESS FOR PRODUCTION THEREOF UNIVERSITY TECHNOLOGIES INTERNATIONAL INC. (CA) 1998-11-18 EP claimed
WO-1998042721-A1 URONIUM SALT CONJUGATE VACCINES LEES ANDREW (US) 1998-10-01 WO claimed
WO-1997048687-A1 PROCESS FOR THE PREPARATION OF CHIRAL KETO-HETEROCYCLES OF BASIC AMINO ACIDS WARNER-LAMBERT COMPANY (US) 1997-12-24 WO claimed
WO-1997023497-A1 LINKER ARM FOR SOLID SUPPORT OLIGONUCLEOTIDE SYNTHESIS AND PROCESS FOR PRODUCTION THEREOF UNIVERSITY TECHNOLOGIES INTERNATIONAL INC. (CA) 1997-07-03 WO claimed
EP-0723554-A1 CYCLIC PEPTIDE TUBE THE SCRIPPS RESEARCH INSTITUTE (US) 1996-07-31 EP claimed
WO-1995010535-A1 CYCLIC PEPTIDE TUBE THE SCRIPPS RESEARCH INSTITUTE (US) 1995-04-20 WO claimed