SCHEMBL563238

SCHEMBL563238

NOCC#Cc1ncccn1

nearest known ligand 0.39

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 1/20 0.32

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
SCHEMBL12892331 0.70
SCHEMBL1151422 0.70 ALDH1A1 (0.39)
SCHEMBL1151875 0.70
SCHEMBL15870986 0.69 HDAC8 (0.39) GRM5
SCHEMBL9741825 0.67 ASIC3 (0.40)
SCHEMBL7471527 0.67 TLR7 (0.39)
SCHEMBL23130857 0.63 TSHR (0.33)
SCHEMBL9741847 0.63 KDM4E (0.47)
SCHEMBL6202613 0.61 CHRM2 (0.43) GRM5
SCHEMBL7469709 0.61 KCNH2 (0.50)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140135485-A1 6-11 BICYCLIC KETOLIDE DERIVATIVES ENANTA PHARMACEUTICALS, INC. (US) 2014-05-15 US disclosed
US-20120035352-A1 6-11 Bicyclic Ketolide Derivatives OR YAT SUN (US) 2012-02-09 US disclosed
EP-1506214-B1 6-11 BICYCLIC KETOLIDE DERIVATIVES ENANTA PHARM INC (US) 2010-01-20 EP disclosed
US-20090324577-A1 6-11 Bicyclic Ketolide Derivatives OR YAT SUN 2009-12-31 US disclosed
US-20070244160-A1 6-11 Bicyclic Ketolide Derivatives OR YAT SUN 2007-10-18 US disclosed
US-7273853-B2 6-11 bicyclic ketolide derivatives ENANTA PHARMACEUTICALS, INC. (US) 2007-09-25 US disclosed
US-7189704-B2 6-11 bicyclic ketolide derivatives ENANTA PHARMACEUTICALS, INC. (US) 2007-03-13 US disclosed
US-7064110-B2 6-11 bicycle ketolide derivatives ENANTA PHARMACEUTICALS, INC. (US) 2006-06-20 US disclosed
US-20050282758-A1 6-11 Bicyclic ketolide derivatives NIU DEQIANG 2005-12-22 US disclosed
US-20050159370-A1 6-11 Bicyclic ketolide derivatives ENANTA PHARMACEUTICALS, INC. (US) 2005-07-21 US disclosed
WO-2005061526-A1 6-11 BICYCLIC KETOLIDE DRIVATIVES ENANTA PHARMACEUTICALS, INC. (US) 2005-07-07 WO disclosed
WO-2005061525-A1 6-11 BICYCLIC KETOLIDE DERIVATIVES ENANTA PHARMACEUTICALS, INC. (US) 2005-07-07 WO disclosed
US-6878691-B2 6-11 bicyclic ketolide derivatives ENANTA PHARMACEUTICALS, INC. (US) 2005-04-12 US disclosed
US-20050037982-A1 6-11 Bicyclic ketolide derivatives ENANTA PHARMACEUTICALS, INC. 2005-02-17 US disclosed
EP-1506214-A1 6-11 BICYCLIC KETOLIDE DERIVATIVES Enanta Pharmaceuticals, Inc. (US) 2005-02-16 EP disclosed
US-20040157787-A1 6-11 Bicyclic ketolide derivatives ENANTA PHARMACEUTICALS, INC. 2004-08-12 US disclosed
WO-2003097659-A1 6-11 BICYCLIC KETOLIDE DERIVATIVES ENANTA PHARMACEUTICALS, INC. (US) 2003-11-27 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 (8 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-20140135485-A1 6-11 BICYCLIC KETOLIDE DERIVATIVES AKR1C2, AKR1C3, AKR1C1 GRM5 3704/4885
US-20120035352-A1 6-11 Bicyclic Ketolide Derivatives AKR1C2, AKR1C3, AKR1C1 GRM5 3704/4885
US-20050282758-A1 6-11 Bicyclic ketolide derivatives AKR1C2, AKR1C3, AKR1C1 GRM5 3704/4885
US-20070244160-A1 6-11 Bicyclic Ketolide Derivatives AKR1C2, AKR1C3, AKR1C1 GRM5 3704/4885
US-20090324577-A1 6-11 Bicyclic Ketolide Derivatives AKR1C2, AKR1C3, AKR1C1 GRM5 3704/4885
US-20050037982-A1 6-11 Bicyclic ketolide derivatives AKR1C2, AKR1C3, AKR1C1 GRM5 3704/4885
US-20040157787-A1 6-11 Bicyclic ketolide derivatives AKR1C2, AKR1C3, AKR1C1 GRM5 3701/4885
US-20050159370-A1 6-11 Bicyclic ketolide derivatives AKR1C2, AKR1C3, AKR1C1 GRM5 3704/4885

“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.