SCHEMBL2094477

SCHEMBL2094477

COc1ccc(Oc2ccccc2-c2ccc(O)cc2)c(OC)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 2/20 0.55
ABCB1 P08183 2/20 0.55
BCR P11274 2/20 0.55
HSP90AA1 P07900 1/20 0.51
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
LMNA P02545 1/20 0.48
MAPT P10636 1/20 0.48
ALOX15 P16050 1/20 0.48
ALOX12 P18054 1/20 0.48
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA7 P43166 1/20 0.47
CA9 Q16790 1/20 0.47
CA14 Q9ULX7 1/20 0.47
SYK P43405 3/20 0.47
BACE1 P56817 1/20 0.47
CYP1A1 P04798 2/20 0.46
CYP1A2 P05177 2/20 0.46

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
SCHEMBL2094476 0.86 CA12 (0.47) ABL1ABCB1BCRMEN1KMT2A
SCHEMBL2097515 0.83 ABL1 (0.58) ABL1ABCB1BCRHSP90AA1LMNA
SCHEMBL2091589 0.82 ABL1 (0.71) ABL1ABCB1BCRHSP90AA1MEN1
SCHEMBL7218648 0.81 CYP3A4 (0.62) ABL1ABCB1BCRCA12CA1
SCHEMBL7610761 0.79 ABL1 (0.60) ABL1ABCB1BCRMAPTCA12
SCHEMBL18593394 0.79 ABL1 (0.59) ABL1ABCB1BCRHSP90AA1MEN1
SCHEMBL29810161 0.79 ABL1 (0.59) ABL1ABCB1BCRHSP90AA1MEN1
SCHEMBL23928778 0.79 ABL1 (0.54) ABL1ABCB1BCRHSP90AA1MEN1
SCHEMBL27700749 0.78 ESR2 (0.59) ABL1ABCB1BCRHSP90AA1CA12
SCHEMBL28255018 0.78 NCOA1 (0.59) ABL1ABCB1BCRMEN1KMT2A

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 2 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-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 ABL1 2379/4885ABCB1 2232/4885BCR 624/4885

“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.