SCHEMBL2089491

SCHEMBL2089491

COc1ccc(-c2ncn[nH]2)cc1-c1ncn[nH]1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 6/20 0.45
ENPP2 Q13822 1/20 0.45
IMPDH2 P12268 1/20 0.43
IMPDH1 P20839 1/20 0.43
KDM4E B2RXH2 5/20 0.41
HSD17B10 Q99714 1/20 0.41
MAPT P10636 1/20 0.41
MAPK14 Q16539 1/20 0.39
ALDH1A1 P00352 1/20 0.39
GAA P10253 1/20 0.39
MPI P34949 1/20 0.39
GFER P55789 1/20 0.39
APOBEC3G Q9HC16 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
LMNA P02545 1/20 0.38
POLB P06746 1/20 0.38
MRGPRX4 Q96LA9 1/20 0.38
ALPL P05186 1/20 0.36
TSHR P16473 1/20 0.36

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
SCHEMBL970690 0.78 IDO1 (0.56) IDO1IMPDH2IMPDH1HSD17B10MAPT
SCHEMBL971690 0.75 KDM4E (0.53) KDM4EHSD17B10ALDH1A1GAAMPI
SCHEMBL6616481 0.74 NPC1 (0.51) KDM4EMAPTALDH1A1GAAMPI
SCHEMBL31418252 0.74 SIRT5 (0.40) IDO1ENPP2IMPDH2IMPDH1KDM4E
SCHEMBL11683086 0.72 IDO1 (0.51) IDO1ENPP2IMPDH2IMPDH1KDM4E
SCHEMBL8541773 0.71 SMPD3 (0.58) KDM4EMAPTALDH1A1
SCHEMBL971261 0.70 CYP1A1 (0.50) IDO1ENPP2KDM4EHSD17B10MAPT
SCHEMBL15859009 0.70 IDO1 (0.54) IDO1ENPP2IMPDH2IMPDH1HSD17B10
SCHEMBL17012446 0.68
SCHEMBL9234967 0.67 NISCH (0.48) IDO1ENPP2KDM4EHSD17B10ALDH1A1

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 IDO1 2665/4885ENPP2 1640/4885IMPDH2 861/4885

“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.