SCHEMBL1685108

SCHEMBL1685108

Nc1ccc(S(=O)(=O)NC2CCNC2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 1/20 0.52
SMN1; SMN2 Q16637 2/20 0.50
NAMPT P43490 1/20 0.50
KDM4E B2RXH2 1/20 0.50
RECQL P46063 1/20 0.50
KDR P35968 1/20 0.46
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
MMP1 P03956 1/20 0.43
MMP2 P08253 1/20 0.43
MMP9 P14780 1/20 0.43
MMP8 P22894 1/20 0.43
MMP13 P45452 1/20 0.43
ALDH1A1 P00352 3/20 0.43
CYP3A4 P08684 1/20 0.43
TSHR P16473 1/20 0.43
MAPK1 P28482 1/20 0.43
HTT P42858 1/20 0.43
PKM P14618 1/20 0.43
MEN1 O00255 1/20 0.41

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
SCHEMBL6191704 0.90 SMN1; SMN2 (0.58) SMN1; SMN2KDM4ERECQLCA1CA2
SCHEMBL17277317 0.84 ALDH1A1 (0.62) HDAC4SMN1; SMN2NAMPTKDM4ERECQL
SCHEMBL6162279 0.84 ALDH1A1 (0.62) HDAC4SMN1; SMN2NAMPTKDM4ERECQL
SCHEMBL2336900 0.84 HDAC4 (0.52) HDAC4SMN1; SMN2NAMPTKDM4ERECQL
SCHEMBL17277502 0.84 ALDH1A1 (0.62) HDAC4SMN1; SMN2NAMPTKDM4ERECQL
SCHEMBL1546166 0.84 HDAC4 (0.51) HDAC4SMN1; SMN2NAMPTKDM4ERECQL
SCHEMBL4071039 0.81 SMN1; SMN2 (0.68) SMN1; SMN2KDM4ERECQLCA1CA2
SCHEMBL12062225 0.81 KMT2A (0.59) HDAC4SMN1; SMN2NAMPTKDM4ERECQL
SCHEMBL12062228 0.81 KMT2A (0.59) HDAC4SMN1; SMN2NAMPTKDM4ERECQL
SCHEMBL17277580 0.81 NAMPT (0.53) HDAC4SMN1; SMN2NAMPTKDM4ERECQL

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-20120010206-A1 IMIDAZOLOPYRIDINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE AND INFLAMMATORY DISEASES GALAPAGOS N. V. (BE) 2012-01-12 US disclosed
US-7951818-B2 Imidazolopyridine compounds useful for the treatment of degenerative and inflammatory diseases GALAPAGOS NV (BE) 2011-05-31 US disclosed
EP-2099798-A1 IMIDAZOLOPYRIDINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE AND INFLAMMATORY DISEASES Galapagos N.V. (BE) 2009-09-16 EP disclosed
US-20090048245-A1 Imidazolopyridine compounds useful for the treatment of degenerative and inflammatory diseases GALAPAGOS NV (BE) 2009-02-19 US disclosed
WO-2008065199-A1 IMIDAZOLOPYRIDINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE AND INFLAMMATORY DISEASES GALAPAGOS N.V. (BE) 2008-06-05 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-20120010206-A1 IMIDAZOLOPYRIDINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE AND INFLAMMATORY DISEASES COL2A1, MMP1, COL1A1 HDAC4 920/4885SMN1; SMN2 649/4885NAMPT 526/4885
US-20090048245-A1 Imidazolopyridine compounds useful for the treatment of degenerative and inflammatory diseases COL2A1, MMP1, COL1A1 HDAC4 920/4885SMN1; SMN2 649/4885NAMPT 526/4885

“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.