SCHEMBL2094086

SCHEMBL2094086

Cc1cccc(C)c1OCO

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN4A P35499 10/20 0.52
CYP2D6 P10635 3/20 0.52
LMNA P02545 2/20 0.52
SCN1A P35498 2/20 0.52
SCN5A Q14524 2/20 0.52
SCN9A Q15858 2/20 0.52
TSHR P16473 2/20 0.52
CYP1A2 P05177 2/20 0.52
CYP3A4 P08684 2/20 0.52
NFKB1 P19838 2/20 0.52
SCN8A Q9UQD0 2/20 0.52
CYP2C9 P11712 1/20 0.52
KCNK3 O14649 1/20 0.52
CACNA1F O60840 1/20 0.52
KCNK2 O95069 1/20 0.52
GBA1 P04062 1/20 0.52
MAOA P21397 1/20 0.52
HTR2A P28223 1/20 0.52
SLC6A4 P31645 1/20 0.52
HTR2B P41595 1/20 0.52

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
SCHEMBL515980 0.81 ALDH1A1 (0.61) SCN4ACYP2D6LMNASCN1ASCN5A
SCHEMBL28456544 0.80 ALDH1A1 (0.62) LMNACYP1A2CYP3A4CYP2C9ALDH1A1
SCHEMBL22696387 0.79 SCN4A (0.56) SCN4ACYP2D6LMNASCN1ASCN5A
SCHEMBL14793094 0.78 SCN5A (0.43) SCN4ACYP2D6LMNASCN1ASCN5A
SCHEMBL2094083 0.77 SCN4A (0.54) SCN4ACYP2D6LMNASCN1ASCN5A
SCHEMBL147753 0.77 SCN4A (0.54) SCN4ACYP2D6LMNASCN1ASCN5A
SCHEMBL18727141 0.75 SCN4A (0.52) SCN4ACYP2D6LMNASCN1ASCN5A
SCHEMBL3036960 0.75 SCN4A (0.52) SCN4ACYP2D6LMNASCN1ASCN5A
SCHEMBL3049215 0.75 SCN4A (0.52) SCN4ACYP2D6LMNASCN1ASCN5A
SCHEMBL293013 0.75 SCN4A (0.52) SCN4ACYP2D6LMNASCN1ASCN5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
US-20090318663-A1 Polymerizable Spherical Transition Metal Complex, Spherical Transition Metal Complex, and Production Method Thereof UNIVERSITY OF TOKYO, THE (JP) 2009-12-24 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
EP-1678185-A1 2,3-DIHYDRO-6-NITROIMIDAZO [2,1-B] OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2006-07-12 EP disclosed
WO-2005042542-A1 2,3-DIHYDRO-6-NITROIMIDAZO (2,1-B) OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2005-05-12 WO 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 SCN4A 2625/4885CYP2D6 743/4885LMNA 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.