SCHEMBL1433992

SCHEMBL1433992

NC(=O)CCCCCC(C(N)=O)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.54
TBXAS1 P24557 3/20 0.43
CYP2C19 P33261 2/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2D6 P10635 1/20 0.42
PKM P14618 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
SLC6A3 Q01959 3/20 0.41
DRD3 P35462 2/20 0.41
LMNA P02545 2/20 0.41
ADORA3 P0DMS8 1/20 0.41
EDNRB P24530 1/20 0.41
MAPK1 P28482 1/20 0.41
MC4R P32245 1/20 0.41
MC3R P41968 1/20 0.41
DRD2 P14416 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.40
MAPT P10636 1/20 0.40
TDP1 Q9NUW8 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
SCHEMBL1065526 0.98 EPHX1 (0.56) EPHX1TBXAS1CYP2C19CYP1A2CYP2D6
SCHEMBL1061595 0.93 EPHX1 (0.58) EPHX1TBXAS1CYP2C19CYP1A2CYP2D6
SCHEMBL27798603 0.90 EPHX1 (0.54) EPHX1TBXAS1CYP2C19CYP1A2CYP2D6
SCHEMBL3353032 0.87 EPHX1 (0.59) EPHX1CYP2C19CYP1A2CYP2D6PKM
SCHEMBL31390534 0.86 HDAC1 (0.54) HDAC1HDAC7ALOX5
SCHEMBL11290597 0.85 ANPEP (0.46) EPHX1LMNAMAPK1L3MBTL1MAPT
SCHEMBL1404164 0.85 EPHX1 (0.53) EPHX1SMN1; SMN2LMNAALDH1A1ASAH1
SCHEMBL4555669 0.85 EPHX1 (0.53) EPHX1SMN1; SMN2LMNAALDH1A1ASAH1
SCHEMBL21359023 0.85 EPHX1 (0.53) EPHX1SMN1; SMN2LMNAALDH1A1ASAH1
SCHEMBL18248508 0.85 EPHX1 (0.53) EPHX1SMN1; SMN2LMNAALDH1A1ASAH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109651199-B Histone deacetylase and microtubule double-target inhibitor and preparation method thereof 青岛大学 2022-01-04 CN claimed
CN-109651199-A A kind of histon deacetylase (HDAC) and the double target spot inhibitor of micro-pipe and preparation method thereof 青岛大学 2019-04-19 CN claimed
EP-3407913-A1 USE OF HISTONE DEACETYLASE INHIBITORS FOR ENHANCING IMMUNOTHERAPIES Indiana University Research & Technology Corporation (US) 2018-12-05 EP claimed
WO-2018160676-A1 COMPOSITIONS AND METHODS FOR REACTIVATING LATENT HIV-1 INFECTIONS UNIVERSITY OF THE SCIENCES (US) 2018-09-07 WO claimed
WO-2017132536-A1 USE OF HISTONE DEACETYLASE INHIBITORS FOR ENHANCING IMMUNOTHERAPIES INDIANA UNIVERSITY RESEARCH & TECHNOLOGY CORPORATION (US) 2017-08-03 WO claimed
US-9693994-B2 Class IIa HDAC inhibitors for the treatment of infection RESEARCH DEVELOPMENT FOUNDATION (US) 2017-07-04 US claimed
WO-2015157500-A1 CLASS IIA HDAC INHIBITORS FOR THE TREATMENT OF INFECTION RESEARCH DEVELOPMENT FOUNDATION (US) 2015-10-15 WO claimed
EP-2544673-A1 THIOXANTHONE-BASED AUTOPHAGY INHIBITOR THERAPIES TO TREAT CANCER Spectrum Pharmaceuticals, Inc. (US) 2013-01-16 EP claimed
WO-2012162535-A1 USE OF PHOSPHATASE INHIBITORS OR HISTONE DEACETYLASE INHIBITORS TO TREAT DISEASES CHARACTERIZED BY LOSS OF PROTEIN FUNCTION LIXTE BIOTECHNOLOGY, INC. (US) 2012-11-29 WO claimed
WO-2011112623-A1 THIOXANTHONE-BASED AUTOPHAGY INHIBITOR THERAPIES TO TREAT CANCER SPECTRUM PHARMACEUTICALS, INC. (US) 2011-09-15 WO claimed
WO-2010028193-A1 COMPOUNDS INCLUDING PIMELIC ACID DERIVATIVES AS HDAC INHIBITORS REPLIGEN CORPORATION (US) 2010-03-11 WO claimed
EP-4731792-A2 COMPOSITIONS COMPRISING ANTINEOPLASTONS AND METHODS OF TREATING LUNG CANCER Burzynski, Stanislaw R. (US) 2026-04-29 EP disclosed
WO-2024263972-A2 COMPOSITIONS COMPRISING ANTINEOPLASTONS AND METHODS OF TREATING UNCOMMON CANCERS BURZYNSKI STANISLAW R (US) 2024-12-26 WO disclosed
WO-2024263963-A2 COMPOSITIONS COMPRISING ANTINEOPLASTONS AND METHODS OF TREATING HEAD AND NECK CANCER BURZYNSKI STANISLAW R (US) 2024-12-26 WO disclosed
WO-2024263804-A2 COMPOSITIONS COMPRISING ANTINEOPLASTONS AND METHODS OF TREATING KIDNEY CANCER BURZYNSKI STANISLAW R (US) 2024-12-26 WO disclosed
WO-2010043904-A2 IMPROVED PROCESS GENERICS [UK] LIMITED (GB) 2010-04-22 WO disclosed
EP-2164480-A1 MUTUAL PRODRUGS AND METHODS TO TREAT CANCER University of Maryland, Baltimore (US) 2010-03-24 EP disclosed
WO-2009139888-A1 ORAL FORMULATIONS OF CYTIDINE ANALOGS AND METHODS OF USE THEREOF CELGENE CORPORATION (US) 2009-11-19 WO disclosed
WO-2008154372-A1 MUTUAL PRODRUGS AND METHODS TO TREAT CANCER UNIVERSITY OF MARYLAND, BALTIMORE (US) 2008-12-18 WO disclosed
WO-2007124435-A2 DETECTION OF HISTONE DEACETYLASE INHIBITION BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2007-11-01 WO disclosed