SCHEMBL103278

SCHEMBL103278

NC(=NO)c1ccc2ccccc2c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 4/20 0.59
GRIN2B Q13224 4/20 0.59
F2 P00734 1/20 0.59
PLG P00747 1/20 0.59
PLAU P00749 1/20 0.59
KLKB1 P03952 1/20 0.59
KLK1 P06870 1/20 0.59
PRSS1 P07477 1/20 0.59
CES2 O00748 1/20 0.52
CES1 P23141 1/20 0.52
NPC1 O15118 4/20 0.47
RAB9A P51151 4/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
LMNA P02545 1/20 0.47
HTR3E A5X5Y0 1/20 0.47
HTR3B O95264 1/20 0.47
HTR3A P46098 1/20 0.47
HTR3D Q70Z44 1/20 0.47
HTR3C Q8WXA8 1/20 0.47
HSP90AA1 P07900 1/20 0.45

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
SCHEMBL29786166 1.00 GRIN1 (0.59) GRIN1GRIN2BF2PLGPLAU
SCHEMBL7035626 1.00 GRIN1 (0.59) GRIN1GRIN2BF2PLGPLAU
SCHEMBL10802010 0.83 LCK (0.62) GRIN1GRIN2BF2PLGPLAU
SCHEMBL19411892 0.82 F12 (0.60) GRIN1GRIN2BNPC1RAB9ALMNA
SCHEMBL17666232 0.82 F12 (0.60) GRIN1GRIN2BNPC1RAB9ALMNA
SCHEMBL2055355 0.80 LMNA (0.45) GRIN1GRIN2BF2PLGPLAU
SCHEMBL2100967 0.80 LMNA (0.45) GRIN1GRIN2BF2PLGPLAU
SCHEMBL17988330 0.78 CES2 (0.56) GRIN1GRIN2BF2PLGPLAU
SCHEMBL23864974 0.77 KDM4E (0.56) GRIN1GRIN2BPLAUPRSS1RAB9A
SCHEMBL22373743 0.77 PLAU (0.61) GRIN1GRIN2BF2PLGPLAU

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11958815-B1 N′-(2-(5-phenyl-1,3,4-oxadiazol-2-ylthio)acetoxy)-2-naphthimidamide as antimicrobial compound King Faisal University (SA) 2024-04-16 US claimed
US-11952354-B1 5-((2-isopropyl-5-methylphenoxy)methyl)-3-(naphthalen-2-yl)-1,2,4-oxadiazole as an anti-cancer and antimicrobial compound King Faisal University (SA) 2024-04-09 US claimed
US-11905262-B1 N′-(2-(5-(4-chlorophenyl)-1,3,4-oxadiazol-2-ylthio)acetoxy)-2-naphthimidamide as an antimicrobial compound King Faisal University (SA) 2024-02-20 US claimed
CN-108440440-B Naphthalene ring-containing 1,2, 4-oxadiazole-cinnamoyl piperazine compound and preparation method and application thereof 贵州医科大学 2021-07-13 CN claimed
US-11976051-B1 N′-(2-(5-(4-chlorophenyl)-1,3,4-oxadiazol-2-ylthio)acetoxy)-2-naphthimidamide as an antimicrobial compound King Faisal University (SA) 2024-05-07 US disclosed
US-20240122179-A1 AUXINIC HERBICIDES AND METHODS OF USE THEREOF CORTEVA AGRISCIENCE LLC (US) 2024-04-18 US disclosed
US-11958815-B1 N′-(2-(5-phenyl-1,3,4-oxadiazol-2-ylthio)acetoxy)-2-naphthimidamide as antimicrobial compound King Faisal University (SA) 2024-04-16 US disclosed
US-11952354-B1 5-((2-isopropyl-5-methylphenoxy)methyl)-3-(naphthalen-2-yl)-1,2,4-oxadiazole as an anti-cancer and antimicrobial compound King Faisal University (SA) 2024-04-09 US disclosed
CN-117813004-A Auxin herbicide and application method thereof 科迪华农业科技有限责任公司 2024-04-02 CN disclosed
US-11905262-B1 N′-(2-(5-(4-chlorophenyl)-1,3,4-oxadiazol-2-ylthio)acetoxy)-2-naphthimidamide as an antimicrobial compound King Faisal University (SA) 2024-02-20 US disclosed
US-9718784-B2 Substituted pyrazoles as heat shock transcription factor activators DUKE UNIVERSITY (US) 2017-08-01 US disclosed
US-9717709-B2 Substituted pyrazoles as heat shock transcription factor activators DUKE UNIVERSITY (US) 2017-08-01 US disclosed
WO-2005123703-A2 ALKYNYL DERIVATIVES AS MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS ADDEX PHARMACEUTICALS SA (CH) 2005-12-29 WO disclosed
US-6329389-B1 HETEROCYCLIC AMINES AND DERIVATIVES, SOMATOSTATIN AND ANTIDIABETIC AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-12-11 US disclosed
EP-1070054-A1 AMINE COMPOUNDS, THEIR PRODUCTION AND THEIR USE AS SOMATOSTATIN RECEPTOR ANTAGONISTS OR AGONISTS Takeda Chemical Industries, Ltd. (JP) 2001-01-24 EP disclosed
WO-1999052875-A1 AMINE COMPOUNDS, THEIR PRODUCTION AND THEIR USE AS SOMATOSTATIN RECEPTOR ANTAGONISTS OR AGONISTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-10-21 WO disclosed
EP-0438230-B1 Indole-substituted five-membered heteroaromatic compounds MERCK SHARP & DOHME (GB) 1997-04-23 EP disclosed
US-5317103-A Migraine treatment MERCK SHARP & DOHME LIMITED (GB) 1994-05-31 US disclosed
EP-0438230-A2 Indole-substituted five-membered heteroaromatic compounds MERCK SHARP & DOHME LTD. (GB) 1991-07-24 EP disclosed
US-4142044-A FLUORESCENT DYES HOECHST AKTIENGESELLSCHAFT (DE) 1979-02-27 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 (5 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-20240122179-A1 AUXINIC HERBICIDES AND METHODS OF USE THEREOF DDT, HACL2, ALAD GRIN1 2925/4885GRIN2B 2999/4885F2 4289/4885
US-11905262-B1 N′-(2-(5-(4-chlorophenyl)-1,3,4-oxadiazol-2-ylthio)acetoxy)-2-naphthimidamide as an antimicrobial compound NIT2, NOC2L, B3GNT2 GRIN1 3096/4885GRIN2B 3893/4885F2 4615/4885
US-11958815-B1 N′-(2-(5-phenyl-1,3,4-oxadiazol-2-ylthio)acetoxy)-2-naphthimidamide as antimicrobial compound NIT2, NOC2L, NANP GRIN1 3606/4885GRIN2B 4318/4885F2 4587/4885
US-11976051-B1 N′-(2-(5-(4-chlorophenyl)-1,3,4-oxadiazol-2-ylthio)acetoxy)-2-naphthimidamide as an antimicrobial compound NIT2, NOC2L, B3GNT2 GRIN1 3220/4885GRIN2B 3953/4885F2 4594/4885
US-11952354-B1 5-((2-isopropyl-5-methylphenoxy)methyl)-3-(naphthalen-2-yl)-1,2,4-oxadiazole as an anti-cancer and antimicrobial compound API5, OXA1L, ING2 GRIN1 3576/4885GRIN2B 4268/4885F2 4798/4885

“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.