SCHEMBL111606

SCHEMBL111606

NC(=O)OCc1c2ccccc2cc2ccccc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.54
HTR2A P28223 1/20 0.50
L3MBTL1 Q9Y468 2/20 0.46
KMT2A Q03164 6/20 0.44
KDM4E B2RXH2 4/20 0.44
ALDH1A1 P00352 4/20 0.44
MEN1 O00255 4/20 0.44
HPGD P15428 3/20 0.44
CYP1A2 P05177 2/20 0.44
GLA P06280 2/20 0.44
HSD17B10 Q99714 2/20 0.44
CYP2C19 P33261 1/20 0.44
GAA P10253 2/20 0.43
GPR35 Q9HC97 2/20 0.42
POLB P06746 1/20 0.42
NQO1 P15559 1/20 0.41
CYP2D6 P10635 1/20 0.40
PKM P14618 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40

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
SCHEMBL14277073 0.85 EPHX1 (0.56) EPHX1HTR2AL3MBTL1KMT2AKDM4E
SCHEMBL20920789 0.83 LMNA (0.47) EPHX1HTR2AL3MBTL1KMT2AKDM4E
SCHEMBL3292664 0.82 EPHX1 (0.54) EPHX1HTR2AL3MBTL1KMT2AKDM4E
SCHEMBL31326117 0.82 EPHX1 (0.54) EPHX1HTR2AL3MBTL1KMT2AKDM4E
SCHEMBL2222008 0.82 EPHX1 (0.54) EPHX1HTR2AL3MBTL1KMT2AKDM4E
SCHEMBL28597702 0.81 EPHX1 (0.60) EPHX1HTR2AL3MBTL1KMT2AKDM4E
SCHEMBL14277072 0.81 KDM4E (0.52) EPHX1HTR2AL3MBTL1KMT2AKDM4E
SCHEMBL8943796 0.81 EPHX1 (0.52) EPHX1HTR2AL3MBTL1KMT2AMEN1
SCHEMBL28324765 0.79 EPHX1 (0.51) EPHX1HTR2AL3MBTL1KMT2AKDM4E
SCHEMBL4809140 0.79 EPHX1 (0.51) EPHX1HTR2AL3MBTL1KMT2AKDM4E

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 3993 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12060334-B2 3-substituted phenazine derivatives as antimicrobial agents UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) 2024-08-13 US claimed
EP-3715346-B1 THIAZOLYL-CONTAINING COMPOUNDS FOR TREATING PROLIFERATIVE DISEASES DANA FARBER CANCER INST INC (US) 2024-01-03 EP claimed
EP-3606528-B1 TRICYCLIC COMPOUNDS AS GLYCOGEN SYNTHASE KINASE 3 (GSK3) INHIBITORS AND USES THEREOF BROAD INST INC (US) 2023-10-18 EP claimed
EP-3291676-B1 MITRAGYNINE ANALOGS AND USES THEREOF MEMORIAL SLOAN KETTERING CANCER CENTER (US) 2022-08-17 EP claimed
CN-109963833-B Process for the preparation of mono-protected alpha, omega-diaminoalkanes 拜奥迪斯私人有限公司 2022-02-22 CN claimed
US-11241435-B2 Uses of salt-inducible kinase (SIK) inhibitors for treating osteoporosis THE GENERAL HOSPITAL CORPORATION (US) 2022-02-08 US claimed
EP-3172213-B1 MACROCYCLIC KINASE INHIBITORS AND USES THEREOF DANA FARBER CANCER INST INC (US) 2021-09-22 EP claimed
EP-3092220-B1 VITAMIN C PRODRUGS AND USES THEREOF UNIV FLORIDA (US) 2021-01-20 EP claimed
EP-3538510-B1 PROCESS FOR THE PREPARATION OF MONO-PROTECTED ALPHA,OMEGA-DIAMINO ALKANES BYONDIS BV (NL) 2021-01-06 EP claimed
US-10870651-B2 Inhibitors of cyclin-dependent kinase 7 (CDK7) DANA-FARBER CANCER INSTITUTE, INC. (US) 2020-12-22 US claimed
EP-1436284-B1 SYNTHESIS OF 4- (Z)-(4-BROMOPHENYL)(ETHOXYIMINO)METHYL]-1'- 2,4-DIMETHYL-1-OXIDO-3-PYRIDINYL)CARBONYL]-4'METHYL-1,4'BIPIPERIDINE SCHERING CORP (US) 2005-08-03 EP claimed
US-20050059800-A1 Process and intermediates for the preparation of (1R,2S,5S)-3-azabicyclo[3,1,0]hexane-2-carboxamide, N-[3-amino-1-(cyclobutylmethyl)-2,3-dioxopropyl]-3-[(2S)-2-[[[1,1-dimethylethyl]amino]carbonylamino]-3,3-dimethyl-1-oxobutyl]-6,6-dimethyl SCHERING CORPORATION 2005-03-17 US claimed
US-20050020689-A1 Process and intermediates for the preparation of 3-(amino)-3-cyclobutylmethyl-2-hydroxy-propionamide or salts thereof SCHERING CORPORATION 2005-01-27 US claimed
WO-2004113272-A1 PROCESS AND INTERMEDIATES FOR THE PREPARATION OF 3-(AMINO)-3-CYCLOBUTYLMETHYL-2-HYDROXY-PROPIONAMIDE OR SALTS THEREOF SCHERING CORPORATION (US) 2004-12-29 WO claimed
WO-2004113294-A1 PROCESS AND INTERMEDIATES FOR THE PREPARATION OF (1R, 2S, 5S)-3-AZABICYCLO[3, 1, 0]HEXANE-2-CARBOXAMIDE, N-[3-AMINO-1-(CYCLOBUTYLMETHYL)-2, 3-DIOXOPROPYL] ]-3-[(2S)-2-[[[1, 1-DIMETHYLETHYL]AMINO]CARBONYLAMINO]-3, 3-DIMETHYL-1-OXOBUTYL]-6, 6-DIMETHYL SCHERING CORPORATION (US) 2004-12-29 WO claimed
US-6818773-B2 AIDS THERAPY; ANTIINFLAMAMTORY AGENTS; ANTIALLERGENS; RHEUMATIC DISEASES SCHERING CORPORATION 2004-11-16 US claimed
EP-1436284-A1 SYNTHESIS OF 4- (Z)-(4-BROMOPHENYL)(ETHOXYIMINO)METHYL]-1'- 2,4-DIMETHYL-1-OXIDO-3-PYRIDINYL)CARBONYL]-4'METHYL-1,4'BIPIPERIDINE SCHERING CORPORATION (US) 2004-07-14 EP claimed
WO-2003033490-A9 SYNTHESIS OF 4-[(Z)-(4-BROMOPHENYL)(ETHOXYIMINO)METHYL]-1'-[2,4-DIMETHYL-1-OXIDO-3-PYRIDINYL)CARBONYL]-4'METHYL-1,4'BIPIPERIDINE SCHERING CORP (US) 2004-06-10 WO claimed
US-20030105131-A1 Synthesis of 4-[(Z)-4-bromophenyl)(ethoxyimino) methyl]-1'-[(2,4-dimethyl-1-oxido-3-pyridinyl)carbonyl]-4'-methyl-1,4-'bipiperidine SCHERING CORPORATION 2003-06-05 US claimed
WO-2003033490-A1 SYNTHESIS OF 4-[(Z)-(4-BROMOPHENYL)(ETHOXYIMINO)METHYL]-1'-[2,4-DIMETHYL-1-OXIDO-3-PYRIDINYL)CARBONYL]-4'METHYL-1,4'BIPIPERIDINE SCHERING CORPORATION (US) 2003-04-24 WO claimed