SCHEMBL2096296

SCHEMBL2096296

[CH2]c1cccc(-c2cc(Cl)cc(Cl)c2)c1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RXRA P19793 2/20 0.50
RXRB P28702 2/20 0.50
CHKA P35790 1/20 0.43
CNR1 P21554 1/20 0.42
ALOX5 P09917 1/20 0.41
TAAR1 Q96RJ0 2/20 0.39
PTPN1 P18031 1/20 0.37
DUSP3 P51452 1/20 0.37
ESR2 Q92731 1/20 0.37
TSHR P16473 1/20 0.36
MAOB P27338 2/20 0.36
NOTUM Q6P988 1/20 0.36
PTGS1 P23219 1/20 0.35
PTGS2 P35354 1/20 0.35
PGR P06401 1/20 0.35
NR1H4 Q96RI1 1/20 0.35
ASIC3 Q9UHC3 1/20 0.34

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
SCHEMBL2088470 0.88 ALOX5 (0.52) ALOX5TAAR1ESR2TSHRMAOB
SCHEMBL1959838 0.83 RXRA (0.59) RXRARXRBCHKACNR1ALOX5
SCHEMBL2091157 0.82 CYP1A2 (0.54) CNR1ALOX5TAAR1MAOBPGR
SCHEMBL4453361 0.80 ALOX5 (0.58) RXRARXRBCHKACNR1ALOX5
SCHEMBL5536643 0.80 AHR (0.43) RXRARXRBCNR1ALOX5TAAR1
SCHEMBL27775798 0.80 HSD17B1 (0.43) ALOX5TAAR1ESR2
SCHEMBL30972562 0.76 RXRA (0.59) RXRARXRBCHKACNR1ALOX5
SCHEMBL95329 0.75 ALDH1A1 (0.50) ALOX5TAAR1ESR2NOTUM
SCHEMBL4494489 0.75 TDP2 (0.42) ESR2PTGS1PTGS2PGR
SCHEMBL13685090 0.73 MAOA (0.48) ALOX5

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 5 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
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 RXRA 179/4885RXRB 138/4885CHKA 3687/4885

“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.