SCHEMBL2090835

SCHEMBL2090835

COC(=O)N(C)c1cccc2ccccc12

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 8/20 0.61
NCEH1 Q6PIU2 9/20 0.47
LMNA P02545 1/20 0.45
ALOX15 P16050 1/20 0.44
TSHR P16473 1/20 0.44
ALDH1A1 P00352 1/20 0.42
PGR P06401 1/20 0.42
GAA P10253 1/20 0.42
PTGS1 P23219 1/20 0.42
MAPK1 P28482 1/20 0.42
HSD17B10 Q99714 1/20 0.42

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
SCHEMBL2090833 0.85 SIGMAR1 (0.59) SIGMAR1NCEH1LMNA
SCHEMBL11570035 0.82 SIGMAR1 (0.56) SIGMAR1NCEH1TSHRALDH1A1
SCHEMBL5923592 0.82 SIGMAR1 (0.56) SIGMAR1NCEH1LMNAGAA
SCHEMBL6003215 0.81 SIGMAR1 (0.54) SIGMAR1NCEH1LMNAALDH1A1
SCHEMBL3626830 0.80 SIGMAR1 (0.67) SIGMAR1TSHRALDH1A1GAA
SCHEMBL29666490 0.80 SIGMAR1 (0.67) SIGMAR1GAA
SCHEMBL1614544 0.80 SIGMAR1 (0.67) SIGMAR1GAA
SCHEMBL28851168 0.79 SIGMAR1 (0.61) SIGMAR1NCEH1ALDH1A1PGRGAA
SCHEMBL27532540 0.79 GAA (0.44) SIGMAR1NCEH1LMNAALDH1A1PGR
SCHEMBL1839015 0.79 SIGMAR1 (0.65) SIGMAR1NCEH1GAA

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103429664-B Photocurable film-forming composition and method for producing cured film NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2016-05-11 CN disclosed
CN-102459415-B Triazine ring-containing polymer and film-forming composition containing same NISSAN CHEMICAL IND LTD 2014-07-02 CN disclosed
CN-103429664-A Photocurable film-forming composition and method for producing cured film NISSAN CHEMICAL IND LTD 2013-12-04 CN disclosed
CN-103270115-A Film-forming composition NISSAN CHEMICAL IND LTD 2013-08-28 CN disclosed
CN-103261273-A Triazine ring-containing polymer and film-forming composition containing the same NISSAN CHEMICAL IND LTD 2013-08-21 CN disclosed
CN-103168066-A Triazine ring-containing polymer and film-forming composition containing the same NISSAN CHEMICAL IND LTD 2013-06-19 CN disclosed
CN-103154138-A Film-forming composition NISSAN CHEMICAL IND LTD 2013-06-12 CN disclosed
US-8163753-B2 2-(4-(4-(4-chlorophenyl)oxazol-2-yl)phenoxymethyl)-2-methyl-6-nitro-2,3-dihydroimidazo[2,1-b]oxazole; bactericide; excellent bactericidal action against Mycobacterium tuberculosis, multi-drug-resistant Mycobacterium tuberculosis, and atypical acid-fast bacteria OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2012-04-24 US disclosed
EP-1678185-B1 2,3-DIHYDRO-6-NITROIMIDAZO [2,1-B] OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS OTSUKA PHARMA CO LTD (JP) 2008-10-08 EP disclosed
US-20080119478-A1 2,3-Dihydro-6-Nitroimidazo (2,1-b) Oxazole Compounds for the Treatment of Tuberculosis OTSUKA PHAMACEUTICAL CO., LTD. (JP) 2008-05-22 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 (1 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-20080119478-A1 2,3-Dihydro-6-Nitroimidazo (2,1-b) Oxazole Compounds for the Treatment of Tuberculosis NR2C2, NR0B2, NR4A2 SIGMAR1 161/4885NCEH1 2204/4885LMNA 4594/4885

“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.