SCHEMBL15052896

SCHEMBL15052896

COc1ccc(Br)cc1S(=O)(=O)N(C)OC

nearest known ligand 0.66

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.66
SMN1; SMN2 Q16637 2/20 0.54
GLA P06280 1/20 0.54
GAA P10253 3/20 0.52
ALDH1A1 P00352 2/20 0.51
MAPK1 P28482 1/20 0.51
ALOX15 P16050 1/20 0.50
HTT P42858 1/20 0.47
ALPL P05186 2/20 0.45
WDR5 P61964 3/20 0.44
EDNRB P24530 2/20 0.44
EDNRA P25101 2/20 0.44
KDM4E B2RXH2 2/20 0.44
KMT2A Q03164 1/20 0.44
PKM P14618 1/20 0.44
MYC P01106 1/20 0.44

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
SCHEMBL15053746 0.87 TSHR (0.69) TSHRSMN1; SMN2GLAGAAALDH1A1
SCHEMBL18545995 0.78 TSHR (0.58) TSHRSMN1; SMN2GLAGAAALDH1A1
SCHEMBL25339530 0.78 TSHR (0.62) TSHRSMN1; SMN2GLAGAAALDH1A1
SCHEMBL1790129 0.78 SMN1; SMN2 (0.65) TSHRSMN1; SMN2GLAGAAALDH1A1
SCHEMBL30514814 0.78 SMN1; SMN2 (0.65) TSHRSMN1; SMN2GLAGAAALDH1A1
SCHEMBL47015 0.76 SMN1; SMN2 (0.64) TSHRSMN1; SMN2GLAGAAALDH1A1
SCHEMBL29902299 0.76 SMN1; SMN2 (0.64) TSHRSMN1; SMN2GLAGAAALDH1A1
SCHEMBL1137871 0.76 SMN1; SMN2 (0.59) TSHRSMN1; SMN2GLAGAAALDH1A1
SCHEMBL7421633 0.76 SMN1; SMN2 (0.59) TSHRSMN1; SMN2GLAGAAALDH1A1
SCHEMBL27584635 0.76 SMN1; SMN2 (0.59) TSHRSMN1; SMN2GLAGAAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2794600-B1 2,3-Dihydro-benzo[1,4]oxazine derivatives and related compounds as phosphoinositide-3 kinase (PI3K) inhibitors for the treatment of e.g. rheumatoid arthritis NOVARTIS AG (CH) 2017-12-06 EP disclosed
EP-2794600-B1 2,3-Dihydro-benzo[1,4]oxazine derivatives and related compounds as phosphoinositide-3 kinase (PI3K) inhibitors for the treatment of e.g. rheumatoid arthritis NOVARTIS AG (CH) 2017-12-06 EP disclosed
US-9763952-B2 Dihydro-benzo-oxazine and dihydro-pyrido-oxazine derivatives NOVARTIS AG (CH) 2017-09-19 US disclosed
US-9763952-B2 Dihydro-benzo-oxazine and dihydro-pyrido-oxazine derivatives NOVARTIS AG (CH) 2017-09-19 US disclosed
US-9763952-B2 Dihydro-benzo-oxazine and dihydro-pyrido-oxazine derivatives NOVARTIS AG (CH) 2017-09-19 US disclosed
US-9539260-B2 Dihydro-benzo-oxazine and dihydro-pyrido-oxazine derivatives NOVARTIS AG (CH) 2017-01-10 US disclosed
US-9539260-B2 Dihydro-benzo-oxazine and dihydro-pyrido-oxazine derivatives NOVARTIS AG (CH) 2017-01-10 US disclosed
US-9539260-B2 Dihydro-benzo-oxazine and dihydro-pyrido-oxazine derivatives NOVARTIS AG (CH) 2017-01-10 US disclosed
US-20160106753-A1 Dihydro-Benzo-Oxazine and Dihydro-Pyrido-Oxazine Derivatives NOVARTIS AG (CH) 2016-04-21 US disclosed
US-20160106753-A1 Dihydro-Benzo-Oxazine and Dihydro-Pyrido-Oxazine Derivatives NOVARTIS AG (CH) 2016-04-21 US disclosed
US-20160106753-A1 Dihydro-Benzo-Oxazine and Dihydro-Pyrido-Oxazine Derivatives NOVARTIS AG (CH) 2016-04-21 US disclosed
US-20130165436-A1 Dihydro-Benzo-Oxazine and Dihydro-Pyrido-Oxazine Derivatives NOVARTIS AG (CH) 2013-06-27 US disclosed
US-20130165436-A1 Dihydro-Benzo-Oxazine and Dihydro-Pyrido-Oxazine Derivatives NOVARTIS AG (CH) 2013-06-27 US disclosed
US-20130165436-A1 Dihydro-Benzo-Oxazine and Dihydro-Pyrido-Oxazine Derivatives NOVARTIS AG (CH) 2013-06-27 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 (2 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-20130165436-A1 Dihydro-Benzo-Oxazine and Dihydro-Pyrido-Oxazine Derivatives PDXK, PDK1, DPYD TSHR 3276/4885SMN1; SMN2 968/4885GLA 825/4885
US-20160106753-A1 Dihydro-Benzo-Oxazine and Dihydro-Pyrido-Oxazine Derivatives PDXK, PDK1, DPYD TSHR 3276/4885SMN1; SMN2 968/4885GLA 825/4885

“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.