SCHEMBL1685115

SCHEMBL1685115

CC(C)N1CCN(C(=O)c2ccc(Nc3ccc(-c4ccc5c(c4)CNC5=O)n4ccnc34)cc2)CC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPKAPK5 Q8IW41 2/20 0.48
HRH3 Q9Y5N1 1/20 0.38
MAPKAPK2 P49137 1/20 0.38
SYK P43405 3/20 0.37
CDK2 P24941 3/20 0.36
CDK4 P11802 2/20 0.36
CCND1 P24385 2/20 0.36
GSK3B P49841 1/20 0.36
EPHX2 P34913 1/20 0.36
CDK6 Q00534 2/20 0.36
CCND3 P30281 1/20 0.36
TYK2 P29597 4/20 0.36
CCNT1 O60563 2/20 0.36
CDK1 P06493 2/20 0.36
CDK9 P50750 2/20 0.36
JAK2 O60674 1/20 0.36
JAK1 P23458 1/20 0.36
JAK3 P52333 1/20 0.36
CFTR P13569 1/20 0.35
ADORA2A P29274 1/20 0.35

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
SCHEMBL1685124 0.93 MAPKAPK5 (0.46) MAPKAPK5MAPKAPK2SYKCDK4CCND1
SCHEMBL13922250 0.91 MAPKAPK5 (0.44) MAPKAPK5SYKCDK2CDK4CCND1
SCHEMBL10133647 0.90 MAPKAPK5 (0.51) MAPKAPK5MAPKAPK2SYKCDK2CDK4
SCHEMBL1685154 0.89 MAPKAPK5 (0.48) MAPKAPK5MAPKAPK2SYKCDK4CCND1
SCHEMBL10134341 0.89 MAPKAPK5 (0.44) MAPKAPK5SYKCDK4CCND1GSK3B
SCHEMBL1685207 0.88 MAPKAPK5 (0.60) MAPKAPK5CDK2CDK4CCND1CDK6
SCHEMBL1685138 0.87 MAPKAPK5 (0.61) MAPKAPK5SYK
SCHEMBL1685148 0.86 HRH3 (0.38) MAPKAPK5HRH3MAPKAPK2SYKCDK2
SCHEMBL12618807 0.86 MAPKAPK5 (0.47) MAPKAPK5HRH3MAPKAPK2SYKCDK2
SCHEMBL1685174 0.86 MAPKAPK5 (0.47) MAPKAPK5MAPKAPK2SYKGSK3BTYK2

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
US-20120010206-A1 IMIDAZOLOPYRIDINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE AND INFLAMMATORY DISEASES GALAPAGOS N. V. (BE) 2012-01-12 US disclosed
US-20120010206-A1 IMIDAZOLOPYRIDINE COMPOUNDS USEFUL FOR THE TREATMENT OF DEGENERATIVE AND INFLAMMATORY DISEASES GALAPAGOS N. V. (BE) 2012-01-12 US disclosed
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
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
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 MAPKAPK5 19/4885HRH3 1575/4885MAPKAPK2 37/4885
US-20090048245-A1 Imidazolopyridine compounds useful for the treatment of degenerative and inflammatory diseases COL2A1, MMP1, COL1A1 MAPKAPK5 19/4885HRH3 1575/4885MAPKAPK2 37/4885

“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.