SCHEMBL3307141

SCHEMBL3307141

CCOC(=O)Cc1ccc(NC(=O)c2ccccc2N)cc1

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.57
SMN1; SMN2 Q16637 5/20 0.57
LMNA P02545 2/20 0.57
KMT2A Q03164 4/20 0.56
KDM4E B2RXH2 3/20 0.56
FFAR1 O14842 1/20 0.53
MEN1 O00255 3/20 0.53
HTT P42858 1/20 0.53
MAPK1 P28482 1/20 0.52
ALDH1A1 P00352 4/20 0.51
HSD17B10 Q99714 1/20 0.51
PTGS1 P23219 1/20 0.51
NPC1 O15118 4/20 0.51
RAB9A P51151 4/20 0.51
GAA P10253 1/20 0.51
HPGD P15428 1/20 0.48
POLB P06746 1/20 0.47
FADS1 O60427 1/20 0.47

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
SCHEMBL20839646 0.86 FADS1 (0.54) SMN1; SMN2KMT2AKDM4EMEN1HTT
SCHEMBL13566616 0.83 LMNA (0.56) MAPTSMN1; SMN2LMNAKMT2AMEN1
SCHEMBL6237411 0.82 GAA (0.60) MAPTSMN1; SMN2LMNAKMT2AKDM4E
SCHEMBL30539412 0.82 ALDH1A1 (0.76) MAPTSMN1; SMN2LMNAKMT2AKDM4E
SCHEMBL5853912 0.81 FFAR1 (0.69) SMN1; SMN2KMT2AFFAR1MEN1ALDH1A1
SCHEMBL27675434 0.80 ALDH1A1 (0.55) MAPTSMN1; SMN2LMNAKMT2AKDM4E
SCHEMBL13566609 0.80 SGMS2 (0.69) MAPTSMN1; SMN2LMNAKMT2AKDM4E
SCHEMBL15183757 0.80 KDM4E (0.53) MAPTLMNAKMT2AKDM4EMEN1
SCHEMBL5798244 0.79 RAB9A (0.72) MAPTSMN1; SMN2LMNAKMT2AKDM4E
SCHEMBL17744848 0.78 PTGS1 (0.75) SMN1; SMN2LMNAKMT2AKDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140187550-A1 BICYCLIC ORGANIC COMPOUNDS SUITABLE FOR THE TREATMENT OF INFLAMMATORY OR ALLERGIC CONDITIONS NOVARTIS AG (CH) 2014-07-03 US disclosed
US-8633211-B2 Bicyclic organic compounds suitable for the treatment of inflammatory or allergic conditions NOVARTIS AG (CH) 2014-01-21 US disclosed
US-20100113774-A1 BICYCLIC ORGANIC COMPOUNDS SUITABLE FOR THE TREATMENT OF INFLAMMATORY OR ALLERGIC CONDITIONS NOVARTIS AG (CH) 2010-05-06 US disclosed
EP-2132186-A1 BICYCLIC ORGANIC COMPOUNDS SUITABLE FOR THE TREATMENT OF INFLAMMATORY OR ALLERGIC CONDITIONS Novartis AG (CH) 2009-12-16 EP disclosed
WO-2008107436-A1 BICYCLIC ORGANIC COMPOUNDS SUITABLE FOR THE TREATMENT OF INFLAMMATORY OR ALLERGIC CONDITIONS NOVARTIS AG (CH) 2008-09-12 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 (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-20100113774-A1 BICYCLIC ORGANIC COMPOUNDS SUITABLE FOR THE TREATMENT OF INFLAMMATORY OR ALLERGIC CONDITIONS S1PR3, S1PR1, S1PR2 MAPT 3853/4885SMN1; SMN2 4130/4885LMNA 2806/4885
US-20140187550-A1 BICYCLIC ORGANIC COMPOUNDS SUITABLE FOR THE TREATMENT OF INFLAMMATORY OR ALLERGIC CONDITIONS S1PR3, S1PR1, S1PR2 MAPT 4020/4885SMN1; SMN2 4399/4885LMNA 2919/4885

“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.