SCHEMBL7576448

SCHEMBL7576448

Cc1ccc2nnsc2c1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.46
RAB9A P51151 3/20 0.46
ALDH1A1 P00352 3/20 0.43
NPC1 O15118 3/20 0.42
POLB P06746 1/20 0.42
BAZ1A Q9NRL2 3/20 0.41
TP53 P04637 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NSD2 O96028 1/20 0.40
NQO2 P16083 1/20 0.39
APP P05067 2/20 0.39
KDM4E B2RXH2 1/20 0.39
GLA P06280 1/20 0.39
GAA P10253 1/20 0.39
THRB P10828 1/20 0.39
LMNA P02545 1/20 0.38
DYRK1A Q13627 1/20 0.38
CYP1A2 P05177 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
SCHEMBL4269185 0.83 ALDH1A1 (0.54) MAPTRAB9AALDH1A1NPC1POLB
SCHEMBL764255 0.78 NPC1 (0.50) MAPTRAB9AALDH1A1NPC1POLB
SCHEMBL8828774 0.75 CNR1 (0.43) MAPTRAB9AALDH1A1NPC1POLB
SCHEMBL1291431 0.74 NPC1 (0.42) MAPTRAB9AALDH1A1NPC1POLB
SCHEMBL2211494 0.74 ALDH1A1 (0.46) MAPTRAB9AALDH1A1NPC1POLB
SCHEMBL1292012 0.74 SMN1; SMN2 (0.46) MAPTRAB9AALDH1A1NPC1POLB
SCHEMBL10630197 0.74 BAZ1A (0.47) MAPTRAB9AALDH1A1NPC1POLB
SCHEMBL507524 0.74 PRMT3 (0.45) MAPTRAB9AALDH1A1NPC1POLB
SCHEMBL508108 0.74 PRMT3 (0.42) MAPTRAB9AALDH1A1NPC1POLB
SCHEMBL29567889 0.74 PRMT3 (0.45) MAPTRAB9AALDH1A1NPC1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1243178-A1 Method for protecting crops from parasitic weeds using benzothiazole derivatives KOGEL, KARL-HEINZ, Prof., Dr. (DE) 2002-09-25 EP claimed
US-6281168-B1 PROTECTING CEREAL CROPS AMERICAN CYANAMID CO. 2001-08-28 US claimed
EP-1021953-A1 Herbicidal compositions and method of safening herbicides using benzothiazole derivatives American Cyanamid Company (US) 2000-07-26 EP claimed
WO-2023014296-A2 MOLECULAR GLUE AND SALL4 DEGRADER NATIONAL UNIVERSITY OF SINGAPORE (SG) 2023-02-09 WO disclosed
US-11229646-B2 Method for treating gonorrhea with (2R)-2-({4-[(3,4-dihydro-2H-pyrano[2,3-C]pyridin-6-ylmethyl)amino]-1-piperidinyl}methyl)-1,2-dihydro-3H,8H-2A,5,8A-triazaacenaphthylene-3,8-dione GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED 2022-01-25 US disclosed
WO-2022015624-A1 SUBSTITUTED DIHYDROPYRAZINEDIONES AS MODULATORS OF THE NMDA RECEPTOR SCHRÖDINGER, INC. (US) 2022-01-20 WO disclosed
US-20200330462-A1 TRICYCLIC NITROGEN CONTAINING COMPOUNDS FOR TREATING NEISSERIA GONORRHOEA INFECTION GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2020-10-22 US disclosed
US-10702521-B2 Methods for treating neisseria gonorrhoeae infection with substituted 1,2-dihydro-2A,5,8A-triazaacenaphthylene-3,8-diones GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2020-07-07 US disclosed
EP-3639824-A1 TRICYCLIC NITROGEN CONTAINING COMPOUNDS FOR TREATING NEISSERIA GONORRHOEA INFECTION GlaxoSmithKline Intellectual Property Development Limited (GB) 2020-04-22 EP disclosed
EP-3182973-B1 TRICYCLIC NITROGEN CONTAINING COMPOUNDS FOR TREATING NEISSERIA GONORRHOEA INFECTION GLAXOSMITHKLINE IP DEV LTD (GB) 2019-09-18 EP disclosed
WO-2018010856-A1 HRI ACTIVATORS USEFUL FOR THE TREATMENT OF CARDIOMETABOLIC DISEASES UNIVERSITAT DE BARCELONA (ES) 2018-01-18 WO disclosed
WO-2008116815-A2 COMPOUNDS GLAXO GROUP LIMITED (GB) 2008-10-02 WO disclosed
WO-2008009700-A1 DERIVATIVES AND ANALOGS OF N-ETHYLQUINOLONES AND N-ETHYLAZAQUINOLONES GLAXO GROUP LIMITED (GB) 2008-01-24 WO disclosed
WO-2008006648-A1 SUBSTITUTED 1-METHYL-1H-QUINOLIN-2-ONES AND 1-METHYL-1H-1,5-NAPHTHYRIDIN-2-ONES AS ANTIBACTERIALS GLAXO GROUP LIMITED (GB) 2008-01-17 WO disclosed
WO-2008003690-A1 AZATRICYCLIC COMPOUNDS AND THEIR USE GLAXO GROUP LIMITED (GB) 2008-01-10 WO disclosed
WO-2007118130-A2 ANTIBACTERIAL AGENTS GLAXO GROUP LIMITED (GB) 2007-10-18 WO disclosed
WO-2007115947-A1 PYRROLO-QUINOXALINONE DERIVATIVES AS ANTIBACTERIALS GLAXO GROUP LIMITED (GB) 2007-10-18 WO disclosed
EP-1243178-A1 Method for protecting crops from parasitic weeds using benzothiazole derivatives KOGEL, KARL-HEINZ, Prof., Dr. (DE) 2002-09-25 EP disclosed
US-6281168-B1 PROTECTING CEREAL CROPS AMERICAN CYANAMID CO. 2001-08-28 US disclosed
EP-1021953-A1 Herbicidal compositions and method of safening herbicides using benzothiazole derivatives American Cyanamid Company (US) 2000-07-26 EP 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 (3 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-20200330462-A1 TRICYCLIC NITROGEN CONTAINING COMPOUNDS FOR TREATING NEISSERIA GONORRHOEA INFECTION NME2, NNMT, NGLY1 MAPT 1672/4885RAB9A 3148/4885ALDH1A1 2255/4885
US-10702521-B2 Methods for treating neisseria gonorrhoeae infection with substituted 1,2-dihydro-2A,5,8A-triazaacenaphthylene-3,8-diones DHPS, HSD17B11, GNE MAPT 2757/4885RAB9A 1577/4885ALDH1A1 300/4885
US-11229646-B2 Method for treating gonorrhea with (2R)-2-({4-[(3,4-dihydro-2H-pyrano[2,3-C]pyridin-6-ylmethyl)amino]-1-piperidinyl}methyl)-1,2-dihydro-3H,8H-2A,5,8A-triazaacenaphthylene-3,8-dione GMPS, GNE, DHPS MAPT 2923/4885RAB9A 3356/4885ALDH1A1 1200/4885

“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.