SCHEMBL1711924

SCHEMBL1711924

COC(=O)C(Br)c1c(F)ccc2ccc(OC)nc12

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 2/20 0.39
MTNR1A P48039 15/20 0.39
MTNR1B P49286 15/20 0.39
HTR2C P28335 4/20 0.36
POLB P06746 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
NNMT P40261 1/20 0.33

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
SCHEMBL3213697 0.86 MTNR1A (0.40) PTGS2MTNR1AMTNR1BHTR2CPOLB
SCHEMBL1711841 0.84 MTNR1A (0.41) PTGS2MTNR1AMTNR1BHTR2CPOLB
SCHEMBL1711856 0.81 MTNR1A (0.41) PTGS2MTNR1AMTNR1BHTR2CPOLB
SCHEMBL3400408 0.79 POLB (0.40) PTGS2MTNR1AMTNR1BHTR2CPOLB
SCHEMBL3229950 0.78 PTGS2 (0.40) PTGS2MTNR1AMTNR1BHTR2CPOLB
SCHEMBL1712087 0.78 PTGS2 (0.38) PTGS2MTNR1AMTNR1BHTR2CPOLB
SCHEMBL1711951 0.76 PTGS2 (0.37) PTGS2MTNR1AMTNR1B
SCHEMBL1723421 0.75 MAPT (0.37) PTGS2MTNR1AMTNR1BPOLB
SCHEMBL3406716 0.74 PTGS2 (0.37) PTGS2MTNR1AMTNR1BHTR2CNNMT
SCHEMBL3214175 0.74 PTGS2 (0.35) PTGS2MTNR1AMTNR1BHTR2CPOLB

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9822114-B2 Tricyclic oxazolidinone antibiotic compounds IDORSIA PHARMACEUTICALS LTD (CH) 2017-11-21 US disclosed
US-20160237088-A1 TRICYCLIC OXAZOLIDINONE ANTIBIOTIC COMPOUNDS IDORSIA PHARMACEUTICALS LTD (CH) 2016-08-18 US disclosed
US-9346804-B2 Tricyclic oxazolidinone antibiotic compounds ACTELION PHARMACEUTICALS LTD. (CH) 2016-05-24 US disclosed
US-20140142093-A1 TRICYCLIC OXAZOLIDINONE ANTIBIOTIC COMPOUNDS ACTELION PHARMACEUTICALS LTD. (CH) 2014-05-22 US disclosed
US-8618092-B2 Tricyclic oxazolidinone antibiotic compounds ACTELION PHARMACEUTICALS LTD. (CH) 2013-12-31 US disclosed
US-20110195961-A1 TRICYCLIC OXAZOLIDINONE ANTIBIOTIC COMPOUNDS ACTELION PHARMACEUTICALS LTD. (CH) 2011-08-11 US disclosed
EP-2344495-A1 TRICYCLIC OXAZOLIDINONE ANTIBIOTIC COMPOUNDS Actelion Pharmaceuticals Ltd. (CH) 2011-07-20 EP disclosed
WO-2010041194-A1 TRICYCLIC OXAZOLIDINONE ANTIBIOTIC COMPOUNDS ACTELION PHARMACEUTICALS LTD (CH) 2010-04-15 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 (3 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-20110195961-A1 TRICYCLIC OXAZOLIDINONE ANTIBIOTIC COMPOUNDS HRH3, OXA1L, HRH1 PTGS2 4023/4885MTNR1A 987/4885MTNR1B 670/4885
US-20160237088-A1 TRICYCLIC OXAZOLIDINONE ANTIBIOTIC COMPOUNDS H1-3, HRH3, HRH4 PTGS2 3735/4885MTNR1A 1089/4885MTNR1B 860/4885
US-20140142093-A1 TRICYCLIC OXAZOLIDINONE ANTIBIOTIC COMPOUNDS OXA1L, H1-3, NGLY1 PTGS2 4066/4885MTNR1A 1119/4885MTNR1B 897/4885

“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.