SCHEMBL1919347

SCHEMBL1919347

CN(C)C=NC(=O)c1ccncc1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.51
KMT2A Q03164 3/20 0.42
KDM4E B2RXH2 2/20 0.42
NAPRT Q6XQN6 1/20 0.42
HSD17B10 Q99714 1/20 0.42
LMNA P02545 1/20 0.41
POLB P06746 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
MPO P05164 1/20 0.40
ALDH1A1 P00352 5/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
NPC1 O15118 1/20 0.39
GAA P10253 1/20 0.39
RAB9A P51151 1/20 0.39
MEN1 O00255 2/20 0.39
HPGD P15428 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
TP53 P04637 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
SCHEMBL1919344 1.00 HTT (0.51) HTTKMT2AKDM4ENAPRTHSD17B10
SCHEMBL3272288 1.00 HTT (0.51) HTTKMT2AKDM4ENAPRTHSD17B10
SCHEMBL1289020 0.81 KDM4E (0.56) HTTKMT2AKDM4ENAPRTPOLB
SCHEMBL1289017 0.81 KDM4E (0.56) HTTKMT2AKDM4ENAPRTPOLB
SCHEMBL21408786 0.81 HCAR2 (0.47) HTTKMT2AKDM4EPOLBL3MBTL1
SCHEMBL21431824 0.81 HCAR2 (0.47) HTTKMT2AKDM4EPOLBL3MBTL1
SCHEMBL11259703 0.80 ALDH1A1 (0.49) HTTKMT2AKDM4EHSD17B10LMNA
SCHEMBL11259705 0.80 ALDH1A1 (0.49) HTTKMT2AKDM4EHSD17B10LMNA
SCHEMBL4901313 0.79 CYP1A2 (0.49) HTTKMT2ALMNAPOLBL3MBTL1
SCHEMBL4901316 0.79 CYP1A2 (0.49) HTTKMT2ALMNAPOLBL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220104493-A1 HERBICIDAL COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2022-04-07 US disclosed
EP-3920701-A1 HERBICIDAL COMPOUNDS Syngenta Crop Protection AG (CH) 2021-12-15 EP disclosed
CN-113412055-A Herbicidal compounds 先正达农作物保护股份公司 2021-09-17 CN disclosed
WO-2020161163-A1 HERBICIDAL COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2020-08-13 WO disclosed
CN-104877001-B Antifungal formulations 西尼克斯公司 2020-07-03 CN disclosed
CN-103159738-B The heteroaryl aroma compounds of alkynyl bridging and application thereof 上海泓博智源医药股份有限公司 2016-09-07 CN disclosed
CN-102491969-B Heteroaromatic quinoline compounds and the purposes as PDE10 inhibitor thereof PFIZER PRODUCTS INC. (US) 2015-08-19 CN disclosed
EP-2326172-B1 ANTIFUNGAL AGENTS SCYNEXIS INC (US) 2014-10-22 EP disclosed
EP-2326172-B1 ANTIFUNGAL AGENTS SCYNEXIS INC (US) 2014-10-22 EP disclosed
US-20130158031-A1 ALKYNE-BRIDGED HETERO-AROMATICS AND USES THEREOF SU ZHOU JING HONG BIOTECH CO., LTD. (CN) 2013-06-20 US disclosed
WO-2010019203-A1 ANTIFUNGAL AGENTS MERCK SHARP & DOHME CORP. (US) 2010-02-18 WO disclosed
US-7429665-B2 Heteroaromatic quinoline compounds PFIZER INC (US) 2008-09-30 US disclosed
US-20080214607-A1 HETEROAROMATIC QUINOLINE COMPOUNDS PFIZER INC 2008-09-04 US disclosed
CN-101098866-A Heteroaromatic quinoline compounds and their use as pde10 inhibitors PFIZER (US) 2008-01-02 CN disclosed
EP-1841757-A2 HETEROAROMATIC QUINOLINE COMPOUNDS AND THEIR USE AS PDE10 INHIBITORS Pfizer Products Incorporated (US) 2007-10-10 EP disclosed
US-20060154931-A1 Heteroaromatic quinoline compounds PFIZER INC 2006-07-13 US disclosed
WO-2006072828-A2 HETEROAROMATIC QUINOLINE COMPOUNDS AND THEIR USE AS PDE10 INHIBITORS PFIZER PRODUCTS INC. (US) 2006-07-13 WO disclosed
EP-0051084-A1 Substituted 1H-1,2,4-triazoles AMERICAN CYANAMID COMPANY (US) 1982-05-12 EP disclosed
US-4329463-A ANTIINFLAMMATORY AGENTS AMERICAN CYANAMID COMPANY (US) 1982-05-11 US disclosed
US-4259504-A ANTIINFLAMMATORY AGENTS, ANTIARTHRITIC AGENTS AMERICAN CYANAMID COMPANY (US) 1981-03-31 US disclosed

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-20220104493-A1 HERBICIDAL COMPOUNDS DDT, ACHE, GSTO1 HTT 673/4885KMT2A 1038/4885KDM4E 1194/4885
US-20060154931-A1 Heteroaromatic quinoline compounds PDE12, PDE7A, PDE4A HTT 834/4885KMT2A 1251/4885KDM4E 1059/4885
US-20130158031-A1 ALKYNE-BRIDGED HETERO-AROMATICS AND USES THEREOF CHRNA10, ATXN10, SCN10A HTT 18/4885KMT2A 1162/4885KDM4E 784/4885
US-20080214607-A1 HETEROAROMATIC QUINOLINE COMPOUNDS PDE12, PDE7A, PDE4A HTT 834/4885KMT2A 1251/4885KDM4E 1059/4885

“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.