SCHEMBL4728174

SCHEMBL4728174

CS(=O)(=O)Nc1ccc(-c2cn3ccccc3n2)cc1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 11/20 0.75
ALDH1A1 P00352 6/20 0.75
POLB P06746 3/20 0.75
MAPT P10636 5/20 0.73
MAPK1 P28482 2/20 0.73
NPSR1 Q6W5P4 1/20 0.73
HDAC6 Q9UBN7 1/20 0.69
HPGD P15428 5/20 0.67
KMT2A Q03164 4/20 0.67
RAB9A P51151 11/20 0.66
SMN1; SMN2 Q16637 6/20 0.66
LMNA P02545 2/20 0.66
MEN1 O00255 2/20 0.65
NPC1 O15118 11/20 0.61
GFER P55789 2/20 0.61
PKM P14618 3/20 0.57
EPHX2 P34913 1/20 0.57
HTT P42858 2/20 0.56
TDP1 Q9NUW8 1/20 0.56
CYP2C19 P33261 1/20 0.54

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
SCHEMBL4727624 0.86 KDM4E (1.00) KDM4EALDH1A1POLBMAPTMAPK1
SCHEMBL19322155 0.84 KDM4E (1.00) KDM4EALDH1A1POLBMAPTMAPK1
SCHEMBL4728028 0.83 MAPT (0.82) KDM4EALDH1A1POLBMAPTMAPK1
Zolimidine SCHEMBL932657 0.82 HDAC6 (1.00) KDM4EALDH1A1POLBMAPTMAPK1
SCHEMBL12799208 0.81 RAB9A (0.65) KDM4EALDH1A1POLBMAPTMAPK1
SCHEMBL30366944 0.81 RAB9A (0.69) KDM4EALDH1A1POLBMAPTMAPK1
Zolimidine SCHEMBL29405502 0.81 HDAC6 (0.97) KDM4EALDH1A1POLBMAPTMAPK1
SCHEMBL13325909 0.81 RAB9A (0.83) KDM4EALDH1A1POLBMAPTMAPK1
SCHEMBL10754624 0.79 KMT2A (1.00) KDM4EALDH1A1POLBMAPTHPGD
SCHEMBL13325938 0.79 RAB9A (0.80) KDM4EALDH1A1POLBMAPTMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008029152-A2 TREATMENT OF DUCHENNE MUSCULAR DYSTROPHY SUMMIT CORPORATION PLC (GB) 2008-03-13 WO disclosed
US-6916826-B2 Substituted imidazo[1,2-a]pyridine derivatives HOFFMAN-LA ROCHE INC. (US) 2005-07-12 US disclosed
US-6861437-B2 Substituted imidazo [1,2-a] pyridine derivatives HOFFMAN-LA ROCHE INC. (US) 2005-03-01 US disclosed
EP-1381363-B1 IMIDAZO [1,2-A]-PYRIDINE DERIVATIVES AS MGLUR5 ANTAGONISTS HOFFMANN LA ROCHE (CH) 2004-12-08 EP disclosed
US-20040180921-A1 Substituted imidazo[1,2-a]pyridine derivatives MUTEL VINCENT (FR) 2004-09-16 US disclosed
EP-1381363-A1 IMIDAZO [1,2-A]-PYRIDINE DERIVATIVES AS MGLUR5 ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2004-01-21 EP disclosed
US-20030212096-A1 Substituted imidazo [1,2-a] pyridine derivatives MUTEL VINCENT (FR) 2003-11-13 US disclosed
US-6596731-B2 An imidazo(1,2-a)pyridine derivative useful for treating chronical or acute neurological disorders, cognitive disorders and memory deficits HOFFMANN-LA ROCHE INC. 2003-07-22 US disclosed
US-20020188128-A1 Substituted imidazo[1,2-A] pyridine derivatives F.HOFFMANN-LA ROCHE AG (CH) 2002-12-12 US disclosed
WO-2002092086-A1 IMIDAZO (1,2-A)-PYRIDINE DERIVATIVES AS MGLUR5 ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2002-11-21 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-20030212096-A1 Substituted imidazo [1,2-a] pyridine derivatives GRM5, GRM1, GRIK5 KDM4E 2868/4885ALDH1A1 1154/4885POLB 4703/4885
US-20040180921-A1 Substituted imidazo[1,2-a]pyridine derivatives GRM5, GRM1, GRIK5 KDM4E 2868/4885ALDH1A1 1154/4885POLB 4703/4885
US-20020188128-A1 Substituted imidazo[1,2-A] pyridine derivatives GRM5, GRM1, GRIK5 KDM4E 2868/4885ALDH1A1 1154/4885POLB 4703/4885

“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.