SCHEMBL970056

SCHEMBL970056

c1coc(-c2csnn2)n1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.37
POLB P06746 3/20 0.37
RAB9A P51151 3/20 0.37
MEN1 O00255 2/20 0.37
NPC1 O15118 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
NOTUM Q6P988 1/20 0.37
LMNA P02545 1/20 0.35
ALDH1A1 P00352 2/20 0.33
HPGDS O60760 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
HPGD P15428 1/20 0.33
CYP2C19 P33261 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
LTA4H P09960 1/20 0.33
MAPT P10636 1/20 0.31
CDC25A P30304 1/20 0.30
CDC25B P30305 1/20 0.30
CDC25C P30307 1/20 0.30

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
SCHEMBL100765 0.69 HPGDS (0.46) HPGDSLTA4H
SCHEMBL1624105 0.69 KMT2A (0.54) KMT2APOLBRAB9AMEN1NPC1
SCHEMBL539177 0.69 NOTUM (0.41) KMT2APOLBRAB9AMEN1NPC1
SCHEMBL1429349 0.69 KDM4A (0.39) RAB9ANPC1SMN1; SMN2ALDH1A1HPGDS
SCHEMBL27360563 0.68 HPGDS (0.37) HPGDSLTA4H
SCHEMBL2170537 0.67 HPGDS (0.33) HPGDSLTA4H
SCHEMBL15600919 0.65 KDM4A (0.43) POLBRAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL291210 0.65 HPGDS (0.34) HPGDSLTA4H
SCHEMBL912864 0.65 LTA4H (0.37) HPGDSLTA4H
SCHEMBL12571337 0.64 HPGDS (0.41) POLBRAB9ANPC1SMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102516268-B Oxazole thiadiazole organic copper compound, its preparation method, preparation and application in controlling agricultural plant diseases UNIV NORTHWEST A&F 2014-08-13 CN claimed
WO-2012088431-A1 FAAH INHIBITORS IRONWOOD PHARMACEUTICALS, INC. (US) 2012-06-28 WO claimed
CN-102516268-A Oxazole thiadiazole organic copper compound, its preparation method, preparation and application in controlling agricultural plant diseases UNIV NORTHWEST A&F 2012-06-27 CN claimed
US-7871982-B2 Lincomycin derivatives and antimicrobial agents comprising the same as active ingredient MEIJI SEIKA KAISHA, LTD. (JP) 2011-01-18 US claimed
US-20090156512-A1 potent activity against resistant pneumococci MEIJI SEIKA KAISHA, LTD. (JP) 2009-06-18 US claimed
EP-1970377-A1 LINCOMYCIN DERIVATIVE AND ANTIBACTERIAL AGENT CONTAINING THE SAME AS ACTIVE INGREDIENT MEIJI SEIKA KAISHA LTD. (JP) 2008-09-17 EP claimed
CN-112175012-A Organic electroluminescent material and device 环球展览公司 2021-01-05 CN disclosed
CN-102516268-B Oxazole thiadiazole organic copper compound, its preparation method, preparation and application in controlling agricultural plant diseases UNIV NORTHWEST A&F 2014-08-13 CN disclosed
CN-102516268-B Oxazole thiadiazole organic copper compound, its preparation method, preparation and application in controlling agricultural plant diseases UNIV NORTHWEST A&F 2014-08-13 CN disclosed
CN-102516268-B Oxazole thiadiazole organic copper compound, its preparation method, preparation and application in controlling agricultural plant diseases UNIV NORTHWEST A&F 2014-08-13 CN disclosed
WO-2012088431-A1 FAAH INHIBITORS IRONWOOD PHARMACEUTICALS, INC. (US) 2012-06-28 WO disclosed
CN-102516268-A Oxazole thiadiazole organic copper compound, its preparation method, preparation and application in controlling agricultural plant diseases UNIV NORTHWEST A&F 2012-06-27 CN disclosed
CN-102516268-A Oxazole thiadiazole organic copper compound, its preparation method, preparation and application in controlling agricultural plant diseases UNIV NORTHWEST A&F 2012-06-27 CN disclosed
EP-1970377-A1 LINCOMYCIN DERIVATIVE AND ANTIBACTERIAL AGENT CONTAINING THE SAME AS ACTIVE INGREDIENT MEIJI SEIKA KAISHA LTD. (JP) 2008-09-17 EP disclosed
US-7259157-B2 N-substituted nonaryl-heterocyclo amidyl NMDA/NR2B Antagonists MERCK & CO., INC. (US) 2007-08-21 US disclosed
US-20060258723-A1 Substituted Heteroaryl- and Phenylsulfamoyl Compounds PFIZER INC 2006-11-16 US disclosed
CN-1763035-A Oligothiophene-arylene derivatives and the OTFT of using it SAMSUNG ELECTRONICS CO LTD (KR) 2006-04-26 CN disclosed
US-20030119811-A1 N-substituted nonaryl-heterocyclo amidyl NMDA/NR2B Antagonists MERCK SHARP & DOHME CORP. 2003-06-26 US disclosed
US-5834468-A ANTIINFLAMMATORY AGENTS, ANTIARTHRITIC AGENTS, ANALGESICS TREATING RHEUMATIC DISEASE, BONE DISORDER, INJURIES ZENECA LIMITED (GB) 1998-11-10 US disclosed
EP-0029934-A1 Benzopyrano derivatives, pharmaceutical compositions containing them and processes for preparing the compounds and compositions SCHERING CORPORATION (US) 1981-06-10 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-20060258723-A1 Substituted Heteroaryl- and Phenylsulfamoyl Compounds PPARG, PPARA, PPARD KMT2A 3601/4885POLB 2006/4885RAB9A 2063/4885
US-20090156512-A1 potent activity against resistant pneumococci H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, NAT1, NPM1 KMT2A 2133/4885POLB 2813/4885RAB9A 377/4885
US-20030119811-A1 N-substituted nonaryl-heterocyclo amidyl NMDA/NR2B Antagonists GRIN1, GRIN2B, GRIN2A KMT2A 1148/4885POLB 4217/4885RAB9A 2382/4885

“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.