SCHEMBL2093582

SCHEMBL2093582

[CH2]OCC(=O)Nc1c(C)cc(C)cc1C

nearest known ligand 0.68

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.59
HPGD P15428 1/20 0.53
NLRP3 Q96P20 1/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
ALDH1A1 P00352 4/20 0.50
POLB P06746 3/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
TSHR P16473 1/20 0.50
ALOX15 P16050 1/20 0.49
MAPT P10636 2/20 0.49
TP53 P04637 1/20 0.48
KDM4E B2RXH2 1/20 0.47

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
SCHEMBL2093587 0.84 LMNA (0.61) LMNAHPGDNLRP3SMN1; SMN2ALDH1A1
SCHEMBL28796266 0.79 LMNA (0.56) LMNAHPGDNLRP3SMN1; SMN2ALDH1A1
SCHEMBL21164704 0.79 LMNA (0.56) LMNAHPGDNLRP3SMN1; SMN2ALDH1A1
SCHEMBL2092062 0.79 LMNA (0.69) LMNAHPGDNLRP3ALDH1A1POLB
SCHEMBL2092059 0.77 LMNA (0.67) LMNAHPGDNLRP3ALDH1A1POLB
SCHEMBL12883186 0.77 TSHR (0.77) LMNAHPGDNLRP3ALDH1A1POLB
SCHEMBL2089477 0.76 NLRP3 (0.56) LMNAHPGDNLRP3ALDH1A1POLB
SCHEMBL3952909 0.76 ALDH1A1 (0.68) LMNAHPGDSMN1; SMN2ALDH1A1POLB
SCHEMBL3899409 0.76 LMNA (0.96) LMNAHPGDNLRP3ALDH1A1POLB
SCHEMBL11578854 0.76 LMNA (0.70) LMNAHPGDALDH1A1POLBMEN1

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 3 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
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 LMNA 4594/4885HPGD 1951/4885NLRP3 1659/4885

“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.