SCHEMBL2092565

SCHEMBL2092565

Oc1ccc2nccc(N3CCC(Oc4ccc(C(F)(F)C(F)(F)F)cc4)CC3)c2c1

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 5/20 0.54
NCF1 P14598 2/20 0.40
PDE3B Q13370 2/20 0.39
PDE3A Q14432 2/20 0.39
PDE10A Q9Y233 1/20 0.39
ADRB2 P07550 1/20 0.38
LIPG Q9Y5X9 3/20 0.37
LIPC P11150 1/20 0.37
ACACB O00763 1/20 0.36
PDGFRB P09619 1/20 0.36
TRPV1 Q8NER1 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
SCHEMBL2092563 0.88 CHRM4 (0.54) CHRM4NCF1PDE3BPDE3APDE10A
SCHEMBL27665997 0.83 CHRM4 (0.48) CHRM4NCF1PDE3BPDE3APDE10A
SCHEMBL2094807 0.82 ENPP1 (0.40) CHRM4NCF1ADRB2LIPG
SCHEMBL2091302 0.78 SCD (0.53) CHRM4PDE10A
SCHEMBL2096022 0.75 ADRB2 (0.49) CHRM4NCF1ADRB2ACACBPDGFRB
SCHEMBL2093722 0.73 LIPG (0.36) CHRM4PDE3BPDE3APDE10ALIPG
SCHEMBL2090364 0.73 SCN10A (0.41) CHRM4PDE3BPDE3APDE10A
SCHEMBL14145381 0.72 CHRM4 (0.52) CHRM4NCF1PDE3BPDE3AACACB
SCHEMBL13874071 0.72 CHRM4 (0.54) CHRM4NCF1PDE3BPDE3AACACB
SCHEMBL3848440 0.72 CHRM4 (0.52) CHRM4NCF1

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 CHRM4 1284/4885NCF1 490/4885PDE3B 3406/4885

“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.