SCHEMBL78773

SCHEMBL78773

CN(C)C(=[O+]n1nnc2ccccc21)N(C)C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 9/20 0.46
POLB P06746 2/20 0.46
MAPK1 P28482 1/20 0.46
ATM Q13315 1/20 0.46
KEAP1 Q14145 1/20 0.46
ALDH1A1 P00352 2/20 0.42
MAPT P10636 2/20 0.42
KMT2A Q03164 2/20 0.42
KDM4E B2RXH2 1/20 0.42
HTT P42858 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
DGAT1 O75907 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
THPO P40225 1/20 0.42
CYP4Z1 Q86W10 1/20 0.42
KCNMA1 Q12791 2/20 0.39
MGAM O43451 1/20 0.38

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
SCHEMBL30378712 1.00 SLC9A1 (0.46) SLC9A1POLBMAPK1ATMKEAP1
SCHEMBL5090298 0.98 SLC9A1 (0.44) SLC9A1POLBMAPK1ATMKEAP1
Bromide SCHEMBL5514455 0.98 SLC9A1 (0.44) SLC9A1POLBMAPK1ATMKEAP1
SCHEMBL1462681 0.98 SLC9A1 (0.44) SLC9A1POLBMAPK1ATMKEAP1
Fluoride Ion SCHEMBL619776 0.97 SLC9A1 (0.43) SLC9A1POLBMAPK1ATMKEAP1
Fluoride SCHEMBL4594157 0.97 SLC9A1 (0.43) SLC9A1POLBMAPK1ATMKEAP1
SCHEMBL44479 0.94 SLC9A1 (0.41) SLC9A1POLBMAPK1ATMKEAP1
SCHEMBL3771511 0.94 SLC9A1 (0.41) SLC9A1POLBMAPK1ATMKEAP1
SCHEMBL5600925 0.94 SLC9A1 (0.41) SLC9A1POLBMAPK1ATMKEAP1
SCHEMBL1941412 0.94 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 2544 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4601744-A1 NEW COMPOUNDS, PROCESSES FOR PREPARING THE SAME AND THEIR USE AS DRUGS B&A Oncomedical (FR) 2025-08-20 EP claimed
EP-3702354-B1 COMPOUND HAVING ERK KINASE INHIBITORY ACTIVITY AND USE THEREOF HAIHE BIOPHARMA CO LTD (CN) 2024-05-22 EP claimed
WO-2024079128-A1 NEW COMPOUNDS, PROCESSES FOR PREPARING THE SAME AND THEIR USE AS DRUGS B&A ONCOMEDICAL (FR) 2024-04-18 WO claimed
EP-3645529-B1 PROCESS FOR PREPARING LIFITEGRAST AND INTERMEDIATES THEREOF SCINOPHARM TAIWAN LTD (TW) 2023-11-22 EP claimed
EP-3630848-B1 PROCESS FOR GALNAC OLIGONUCLEOTIDE CONJUGATES HOFFMANN LA ROCHE (CH) 2023-10-04 EP claimed
EP-3609892-B1 IMPROVED SYNTHESIS OF NIR FLUORESCENT PROBE BRACCO IMAGING SPA (IT) 2022-01-12 EP claimed
EP-3160984-B1 PROCESS FOR PREPARING D-ARGINYL-2,6-DIMETHYL-L-TYROSYL-L-LYSYL-L-PHENYLALANINAMIDE FLAMMA SPA (IT) 2021-04-14 EP claimed
EP-3438096-B1 MANUFACTURING PROCESS FOR 1-(ARYLMETHYL) QUINAZOLINE-2,4 (1H, 3H)-DIONE IMPACT THERAPEUTICS INC (CN) 2020-12-02 EP claimed
EP-3558977-B1 PROCESS FOR PREPARING TETRAHYDROCARBAZOLE CARBOXAMIDE COMPOUND BRISTOL MYERS SQUIBB CO (US) 2020-10-28 EP claimed
US-10730888-B2 Process for the preparation of dolutegravir MYLAN LABORATORIES LIMITED (IN) 2020-08-04 US claimed
WO-2000012554-A1 METHOD FOR MARKED CHEMOKINE SYNTHESIS, MARKED CHEMOKINE AND ANALYSIS KIT COMMISSARIAT A L'ENERGIE ATOMIQUE (FR) 2000-03-09 WO claimed
EP-0971945-A1 URONIUM SALT CONJUGATE VACCINES Lees, Andrew (US) 2000-01-19 EP claimed
WO-1999064406-A1 A PROCESS FOR THE PREPARATION OF MACROCYCLIC METALLOPROTEASE INHIBITORS DU PONT PHARMACEUTICALS COMPANY (US) 1999-12-16 WO claimed
WO-1999041242-A1 DI-SUBSTITUTED NAPHTHYL DERIVATIVES, PREPARATION THEREOF, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM RHONE-POULENC RORER S.A. (FR) 1999-08-19 WO claimed
WO-1998042721-A1 URONIUM SALT CONJUGATE VACCINES LEES ANDREW (US) 1998-10-01 WO claimed
US-5446134-A Reacting bis(fluorosulfonyl)methane salt with cyanogen halide or pseudohalide CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 1995-08-29 US claimed
EP-0665239-A1 Peptide derivatives of bactenecin endowed with antibacterial activity CONSIGLIO NAZIONALE DELLE RICERCHE (IT) 1995-08-02 EP claimed
EP-0565646-A4 1994-08-03 EP claimed
EP-0565646-A1 NUCLEOSIDES AND OLIGONUCLEOSIDES WITH A PHOSPHATE-FREE INTERNUCLEOSIDE BACKBONE AND PROCESS FOR PREPARING THE SAME BAYLOR COLLEGE OF MEDICINE (US) 1993-10-20 EP claimed
WO-1992018518-A1 NUCLEOSIDES AND OLIGONUCLEOSIDES WITH A PHOSPHATE-FREE INTERNUCLEOSIDE BACKBONE AND PROCESS FOR PREPARING THE SAME BAYLOR COLLEGE OF MEDICINE (US) 1992-10-29 WO claimed