SCHEMBL12618751

SCHEMBL12618751

O=C(NCc1ccc(O)cc1)c1ccc(Nc2ccc(-c3cc[nH]c(=O)c3)n3ccnc23)cc1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPKAPK5 Q8IW41 2/20 0.42
HDAC1 Q13547 3/20 0.40
KDM1A O60341 2/20 0.40
MT-CO2 P00403 2/20 0.40
ALDH2 P05091 8/20 0.38
ROCK2 O75116 1/20 0.37
SYK P43405 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
MAPK8 P45983 2/20 0.36

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
SCHEMBL13922255 0.93 HDAC6 (0.44) MAPKAPK5HDAC1KDM1AALDH2RXFP1
SCHEMBL12618789 0.92 SYK (0.43) MAPKAPK5MT-CO2ROCK2SYKRXFP1
SCHEMBL13922253 0.91 BTK (0.45) MAPKAPK5
SCHEMBL12618809 0.91 KDM1A (0.42) MAPKAPK5HDAC1KDM1AALDH2ROCK2
SCHEMBL12618788 0.90 MAPT (0.45) MAPKAPK5HDAC1ALDH2ROCK2
SCHEMBL12618901 0.90 MAPKAPK5 (0.41) MAPKAPK5HDAC1KDM1AALDH2SYK
SCHEMBL12618762 0.88 ALDH1A1 (0.44) MAPKAPK5ROCK2
SCHEMBL1674304 0.88 MAPKAPK5 (0.57) MAPKAPK5HDAC1KDM1AALDH2MAPK8
SCHEMBL12618857 0.86 MAPKAPK5 (0.45) MAPKAPK5SYK
SCHEMBL13922270 0.85 MAPKAPK5 (0.46) MAPKAPK5ROCK2SYKMAPK8

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-7951818-B2 Imidazolopyridine compounds useful for the treatment of degenerative and inflammatory diseases GALAPAGOS NV (BE) 2011-05-31 US disclosed
US-7951818-B2 Imidazolopyridine compounds useful for the treatment of degenerative and inflammatory diseases GALAPAGOS NV (BE) 2011-05-31 US disclosed
US-20090048245-A1 Imidazolopyridine compounds useful for the treatment of degenerative and inflammatory diseases GALAPAGOS NV (BE) 2009-02-19 US 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 (1 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-20090048245-A1 Imidazolopyridine compounds useful for the treatment of degenerative and inflammatory diseases COL2A1, MMP1, COL1A1 MAPKAPK5 19/4885HDAC1 1487/4885KDM1A 2804/4885

“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.