SCHEMBL1044238

SCHEMBL1044238

CCC(CC)N1CCN(c2ccc(Nc3ccc(-c4ccnc(OC)c4)n4ncnc34)cc2)CC1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPKAPK5 Q8IW41 3/20 0.39
FGFR1 P11362 1/20 0.37
JAK2 O60674 3/20 0.37
KDM1A O60341 2/20 0.36
TNIK Q9UKE5 2/20 0.35
MAPKAPK2 P49137 2/20 0.35
CFTR P13569 1/20 0.34
MITF O75030 1/20 0.34
RAD52 P43351 1/20 0.34
CSNK2A2 P19784 4/20 0.34
CSNK2A1 P68400 4/20 0.34

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
SCHEMBL1047450 0.89 FGFR1 (0.46) MAPKAPK5FGFR1JAK2KDM1AMITF
SCHEMBL1048208 0.88 MAPKAPK5 (0.49) MAPKAPK5JAK2KDM1ATNIKMAPKAPK2
SCHEMBL1047059 0.87 MAPKAPK5 (0.41) MAPKAPK5FGFR1JAK2KDM1ATNIK
SCHEMBL12618640 0.86 MAPKAPK5 (0.39) MAPKAPK5JAK2TNIKMAPKAPK2MITF
SCHEMBL1042546 0.85 MAPKAPK5 (0.39) MAPKAPK5FGFR1JAK2KDM1ATNIK
SCHEMBL1046069 0.85 ACVR1 (0.44) MAPKAPK5FGFR1JAK2TNIKMAPKAPK2
SCHEMBL1044786 0.83 ACVR1 (0.42) MAPKAPK5FGFR1JAK2CSNK2A2CSNK2A1
SCHEMBL1046311 0.83 ACVR1 (0.42) MAPKAPK5FGFR1JAK2CSNK2A2CSNK2A1
SCHEMBL1045286 0.82 MAPKAPK5 (0.56) MAPKAPK5FGFR1JAK2KDM1AMITF
SCHEMBL1045465 0.82 MAPKAPK5 (0.60) MAPKAPK5FGFR1KDM1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7977352-B2 Triazolopyridine compounds useful for the treatment of degenerative and inflammatory diseases GALAPAGOS NV (BE) 2011-07-12 US claimed
EP-2086540-A1 TRIAZOLOPYRIDINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE & INFLAMMATORY DISEASES Galapagos N.V. (BE) 2009-08-12 EP claimed
US-20090105242-A1 Triazolopyridine compounds useful for the treatment of degenerative & inflammatory diseases GALAPAGOS NV (BE) 2009-04-23 US claimed
WO-2008065198-A1 TRIAZOLOPYRIDINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE & INFLAMMATORY DISEASES GALAPAGOS N.V. (BE) 2008-06-05 WO claimed
US-7977352-B2 Triazolopyridine compounds useful for the treatment of degenerative and inflammatory diseases GALAPAGOS NV (BE) 2011-07-12 US disclosed
US-7977352-B2 Triazolopyridine compounds useful for the treatment of degenerative and inflammatory diseases GALAPAGOS NV (BE) 2011-07-12 US disclosed
US-7977352-B2 Triazolopyridine compounds useful for the treatment of degenerative and inflammatory diseases GALAPAGOS NV (BE) 2011-07-12 US disclosed
EP-2086540-B8 TRIAZOLOPYRIDINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE & INFLAMMATORY DISEASES GALAPAGOS NV (BE) 2011-03-02 EP disclosed
EP-2086540-B1 TRIAZOLOPYRIDINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE & INFLAMMATORY DISEASES GALAPAGOS NV (BE) 2011-01-19 EP disclosed
EP-2086540-A1 TRIAZOLOPYRIDINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE & INFLAMMATORY DISEASES Galapagos N.V. (BE) 2009-08-12 EP disclosed
US-20090105242-A1 Triazolopyridine compounds useful for the treatment of degenerative & inflammatory diseases GALAPAGOS NV (BE) 2009-04-23 US disclosed
US-20090105242-A1 Triazolopyridine compounds useful for the treatment of degenerative & inflammatory diseases GALAPAGOS NV (BE) 2009-04-23 US disclosed
US-20090105242-A1 Triazolopyridine compounds useful for the treatment of degenerative & inflammatory diseases GALAPAGOS NV (BE) 2009-04-23 US disclosed
WO-2008065198-A1 TRIAZOLOPYRIDINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE & 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-20090105242-A1 Triazolopyridine compounds useful for the treatment of degenerative & inflammatory diseases COL2A1, MMP1, COL1A1 MAPKAPK5 15/4885FGFR1 1098/4885JAK2 1392/4885

“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.