SCHEMBL4016091

SCHEMBL4016091

Nc1nc2cc(CO)ccc2o1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.56
ALOX15 P16050 2/20 0.56
LMNA P02545 1/20 0.56
CYP1A2 P05177 1/20 0.56
THRB P10828 1/20 0.56
MAPK1 P28482 1/20 0.56
CA12 O43570 1/20 0.45
CA2 P00918 1/20 0.45
CA3 P07451 1/20 0.45
CA4 P22748 1/20 0.45
CA6 P23280 1/20 0.45
CA5A P35218 1/20 0.45
CA7 P43166 1/20 0.45
CA9 Q16790 1/20 0.45
CA14 Q9ULX7 1/20 0.45
CA5B Q9Y2D0 1/20 0.45
MEN1 O00255 4/20 0.44
ALDH1A1 P00352 4/20 0.44
RAB9A P51151 4/20 0.44
KMT2A Q03164 4/20 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
SCHEMBL9380420 0.86 PIK3CG (0.56) MAPTALOX15LMNACYP1A2THRB
SCHEMBL4019751 0.82 MAPT (0.61) MAPTALOX15LMNACYP1A2THRB
SCHEMBL240344 0.82 RAB9A (0.63) MAPTALOX15LMNACYP1A2THRB
SCHEMBL18405092 0.79 MAPT (0.53) MAPTALOX15LMNACYP1A2THRB
SCHEMBL20748550 0.79 MAPT (0.53) MAPTALOX15LMNACYP1A2THRB
SCHEMBL4025674 0.79 MAPT (0.53) MAPTALOX15LMNACYP1A2THRB
SCHEMBL17153860 0.79 CA12 (0.45) MAPTALOX15CA12CA2CA3
SCHEMBL17221544 0.79 GAA (0.51) MAPTLMNAMAPK1CA12CA2
SCHEMBL13765046 0.78 MAPT (0.51) MAPTALOX15LMNACYP1A2THRB
SCHEMBL30058638 0.78 PSMB8 (0.59) MAPTALOX15CA12CA2CA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7563877-B2 Processes for the preparation of 0-(2-aminobenzo[d]oxazol-5-yl)methyl hydroxylamine for the synthesis of 6,11-bicyclic erythromycin derivative EDP-182 ENANTA PHARMACEUTICALS, INC. (US) 2009-07-21 US claimed
US-20070207972-A1 Processes for the preparation of 0-(2-aminobenzo[d]oxazol-5-yl)methyl hydroxylamine for the synthesis of 6,11-bicyclic erythromycin derivative EDP-182 ENANTA PHARMACEUTICALS, INC. 2007-09-06 US claimed
EP-2678016-B1 HETEROCYCLIC COMPOUNDS AND USES THEREOF INTELLIKINE LLC (US) 2016-08-10 EP disclosed
US-20150320727-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF INTELLIKINE, LLC 2015-11-12 US disclosed
WO-2014151147-A1 COMBINATION OF KINASE INHIBITORS AND USES THEREOF INTELLIKINE, LLC (US) 2014-09-25 WO disclosed
US-20100041618-A1 6-11 Bridged Oxime Erythromycin Derivatives ENANTA PHARMACEUTICALS, INC. 2010-02-18 US disclosed
US-7563877-B2 Processes for the preparation of 0-(2-aminobenzo[d]oxazol-5-yl)methyl hydroxylamine for the synthesis of 6,11-bicyclic erythromycin derivative EDP-182 ENANTA PHARMACEUTICALS, INC. (US) 2009-07-21 US disclosed
US-7563877-B2 Processes for the preparation of 0-(2-aminobenzo[d]oxazol-5-yl)methyl hydroxylamine for the synthesis of 6,11-bicyclic erythromycin derivative EDP-182 ENANTA PHARMACEUTICALS, INC. (US) 2009-07-21 US disclosed
US-20080262208-A1 6-11 Bridged Oxime Erythromycin Derivatives WANG GUOQIANG 2008-10-23 US disclosed
US-7384922-B2 6-11 bridged oxime erythromycin derivatives ENANTA PHARMACEUTICALS, INC. (US) 2008-06-10 US disclosed
US-20070207972-A1 Processes for the preparation of 0-(2-aminobenzo[d]oxazol-5-yl)methyl hydroxylamine for the synthesis of 6,11-bicyclic erythromycin derivative EDP-182 ENANTA PHARMACEUTICALS, INC. 2007-09-06 US disclosed
US-20070207972-A1 Processes for the preparation of 0-(2-aminobenzo[d]oxazol-5-yl)methyl hydroxylamine for the synthesis of 6,11-bicyclic erythromycin derivative EDP-182 ENANTA PHARMACEUTICALS, INC. 2007-09-06 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 (4 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-20100041618-A1 6-11 Bridged Oxime Erythromycin Derivatives CYP2D6, CYP2B6, CYP1B1 MAPT 4013/4885ALOX15 609/4885LMNA 4380/4885
US-20070207972-A1 Processes for the preparation of 0-(2-aminobenzo[d]oxazol-5-yl)methyl hydroxylamine for the synthesis of 6,11-bicyclic erythromycin derivative EDP-182 DHPS, TET1, TET2 MAPT 4438/4885ALOX15 2775/4885LMNA 1591/4885
US-20150320727-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF PIK3CA, PIK3CD, PIK3CB MAPT 2704/4885ALOX15 2381/4885LMNA 2098/4885
US-20080262208-A1 6-11 Bridged Oxime Erythromycin Derivatives CYP2D6, CYP2B6, CYP1B1 MAPT 4013/4885ALOX15 609/4885LMNA 4380/4885

“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.