SCHEMBL406614

SCHEMBL406614

NNC(=O)c1ccccc1Cl

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.69
HPGD P15428 3/20 0.60
CYP1A2 P05177 2/20 0.60
KDM4E B2RXH2 2/20 0.60
ALDH1A1 P00352 2/20 0.60
CYP2C19 P33261 1/20 0.60
MAPT P10636 1/20 0.60
CES2 O00748 1/20 0.58
CES1 P23141 1/20 0.58
NPC1 O15118 1/20 0.56
RAB9A P51151 1/20 0.56
CA1 P00915 1/20 0.53
CA2 P00918 1/20 0.53
CA9 Q16790 1/20 0.53
CTSD P07339 1/20 0.53
ERCC5 P28715 1/20 0.53
FEN1 P39748 1/20 0.53
SMO Q99835 1/20 0.53
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53

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
Hydrochloric Acid SCHEMBL2452557 0.98 POLB (0.67) POLBHPGDCYP1A2KDM4EALDH1A1
Acetonitrile SCHEMBL28068508 0.89 POLB (0.56) POLBHPGDCYP1A2KDM4EALDH1A1
SCHEMBL30547074 0.84 CTSD (0.63) KDM4EALDH1A1MAPTCA1CA2
SCHEMBL239328 0.84 CTSD (0.63) KDM4EALDH1A1MAPTCA1CA2
SCHEMBL27539648 0.83 HPGD (0.61) POLBHPGDCYP1A2KDM4EALDH1A1
SCHEMBL3607272 0.83 KLKB1 (0.61) POLBKDM4EALDH1A1MAPTCA1
SCHEMBL4384455 0.83 TAS1R3 (0.60) POLBKDM4EALDH1A1MAPTNPC1
SCHEMBL8373805 0.82 POLB (1.00) POLBHPGDCYP1A2KDM4EALDH1A1
SCHEMBL10558954 0.82 ALDH1A1 (0.50) POLBHPGDKDM4EALDH1A1MAPT
SCHEMBL47348 0.82 POLB (0.62) POLBHPGDCYP1A2KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117402125-A Preparation method of noo Bo Suan oxadiazole thioester compound, product and application thereof 南京林业大学 2024-01-16 CN claimed
US-11398630-B2 Method of generating energy from a hydrazide containing anode fuel, and fuel cell IOWA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 2022-07-26 US claimed
US-20210005900-A1 METHOD OF GENERATING ENERGY FROM A HYDRAZIDE CONTAINING ANODE FUEL, AND FUEL CELL IOWA STATE UNIVERSITY RESEARCH FOUNDATION, INC. 2021-01-07 US claimed
CN-106397420-B 3- (5- aryl-1,3,4-oxdiazole -2- bases) asarinin analog derivative, preparation method and application 郑州大学 2018-10-09 CN claimed
US-10040741-B2 Method for manufacturing high purity glycol based compound SAMSUNG DISPLAY CO., LTD. (KR) 2018-08-07 US claimed
CN-107973807-A Triazolobenzothiazole derivative and preparation method and application thereof 唐山学院 2018-05-01 CN claimed
CN-106380475-B A kind of thieno [2,3 d] pyrimidines and its preparation method and application 湖北民族学院 2018-03-09 CN claimed
CN-107188827-A The preparation method of o-chlorobenzoyl hydrazine 重庆锦杉科技有限公司 2017-09-22 CN claimed
CN-106928088-A A kind of synthetic method of o-chlorobenzoyl hydrazine 李亚杉 2017-07-07 CN claimed
CN-106397420-A 3-(5-aryl-1,3-4-oxadiazole-2-yl)sarisan derivatives, and preparation method and application thereof 郑州大学 2017-02-15 CN claimed
US-20080245233-A1 Method for Inhibiting Fouling in Basic Washing Systems BAKER HUGHES INCORPORATED (US) 2008-10-09 US claimed
EP-1602678-B1 Cure accelerators HEXCEL COMPOSITES LTD (GB) 2008-06-11 EP claimed
US-20050272883-A1 Cure accelerators HEXCEL COMPOSITES, LTD. (GB) 2005-12-08 US claimed
US-20050239853-A1 New compounds BIOVITRUM AB (SE) 2005-10-27 US claimed
WO-2005075471-A2 THIAZOL-COMPOUNDS AS 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 INHIBITORS BIOVITRUM AB (SE) 2005-08-18 WO claimed
US-20030105140-A1 Substituted indole-2-carboxylic acid benzylidene-hydrazides and analogs as activators of caspases and inducers of apoptosis and the use thereof CYTOVIA, INC. 2003-06-05 US claimed
WO-2002102301-A2 SUBSTITUTED INDOLE-2-CARBOXYLIC ACID BENZYLIDENE-HYDRAZIDES AND ANALOGS AS ACTIVATORS OF CASPASES AND INDUCERS OF APOPTOSIS AND THE USE THEREOF CYTOVIA, INC. (US) 2002-12-27 WO claimed
US-20020128292-A1 Substituted indole-2-carboxylic acid benzylidene-hydrazides and analogs as activators of caspases and inducers of apoptosis and the use thereof CYTOVIA, INC. 2002-09-12 US claimed
EP-0140886-B1 FILM BADGE FOR DETERMINING CARBONYL COMPOUNDS Crystal Diagnostic Systems, Inc. (US) 1988-09-07 EP claimed
US-4229463-A ANTICHOLESTEROL AGENTS FOR REDUCING CHOLESTEROL ESTER CONTENT OF ARTERIAL WALLS SANDOZ, INC. (US) 1980-10-21 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020128292-A1 Substituted indole-2-carboxylic acid benzylidene-hydrazides and analogs as activators of caspases and inducers of apoptosis and the use thereof BAD, API5, CASP2 POLB 4305/4885HPGD 516/4885CYP1A2 502/4885
US-20030105140-A1 Substituted indole-2-carboxylic acid benzylidene-hydrazides and analogs as activators of caspases and inducers of apoptosis and the use thereof BAD, API5, CASP2 POLB 4305/4885HPGD 516/4885CYP1A2 502/4885
US-20050239853-A1 New compounds HSD11B1, CYP11B1, HSD3B1 POLB 1038/4885HPGD 66/4885CYP1A2 48/4885
US-10040741-B2 Method for manufacturing high purity glycol based compound GK, GMDS, UGCG POLB 2497/4885HPGD 172/4885CYP1A2 1025/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.