SCHEMBL2093430

SCHEMBL2093430

CC=C(OC)c1cccc(OC(F)(F)F)c1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 1/20 0.46
TAS1R1 Q7RTX1 1/20 0.46
TAS1R2 Q8TE23 1/20 0.46
PTPN1 P18031 1/20 0.46
KAT6A Q92794 4/20 0.45
HDAC8 Q9BY41 1/20 0.44
MRGPRX4 Q96LA9 1/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
GPR139 Q6DWJ6 1/20 0.43
F10 P00742 1/20 0.41
MAOB P27338 1/20 0.41
DDR1 Q08345 2/20 0.40
NAMPT P43490 1/20 0.39

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
SCHEMBL2093782 0.83 NPC1 (0.38) PTPN1MRGPRX4NPC1RAB9A
SCHEMBL2096154 0.81 CES2 (0.58) NPC1RAB9AMAOB
SCHEMBL15624322 0.80 TAS1R3 (0.45) TAS1R3TAS1R1TAS1R2KAT6AHDAC8
SCHEMBL7055657 0.80 MRGPRX4 (0.63) TAS1R3TAS1R1TAS1R2PTPN1KAT6A
SCHEMBL2095723 0.80 KAT6A (0.47) TAS1R3TAS1R1TAS1R2KAT6AHDAC8
SCHEMBL2088584 0.80 TRPV1 (0.45) MRGPRX4NPC1RAB9A
SCHEMBL16959752 0.78 TAS1R3 (0.48) TAS1R3TAS1R1TAS1R2KAT6AHDAC8
SCHEMBL2093794 0.77 NPSR1 (0.54)
SCHEMBL27743203 0.76 TAS1R3 (0.50) TAS1R3TAS1R1TAS1R2KAT6AHDAC8
SCHEMBL16955347 0.75 TAS1R3 (0.44) TAS1R3TAS1R1TAS1R2KAT6AHDAC8

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 TAS1R3 614/4885TAS1R1 512/4885TAS1R2 244/4885

“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.