SCHEMBL1685245

SCHEMBL1685245

CN(C)C1CCN(C(=O)c2ccc(Nc3ccc(-c4ccc5c(c4)C=NC5=O)n4ccnc34)cc2F)C1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ATR Q13535 6/20 0.39
JAK2 O60674 2/20 0.38
BRD4 O60885 2/20 0.38
CSF1R P07333 1/20 0.38
CDK4 P11802 1/20 0.38
CDK6 Q00534 1/20 0.38
PIK3CA P42336 5/20 0.38
MTOR P42345 5/20 0.38
JAK1 P23458 1/20 0.37
BRD2 P25440 1/20 0.37
JAK3 P52333 1/20 0.37
BRD3 Q15059 1/20 0.37
BRDT Q58F21 1/20 0.37
MAPKAPK5 Q8IW41 1/20 0.36
SMO Q99835 1/20 0.35
KDM1A O60341 2/20 0.34
CDK1 P06493 2/20 0.34
CDK2 P24941 2/20 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
SCHEMBL3881243 0.90 CDK1 (0.39) ATRJAK2JAK1KDM1ACDK1
SCHEMBL1685248 0.88 MAPKAPK5 (0.42) ATRJAK2BRD4CSF1RCDK4
SCHEMBL10166023 0.82 CSF1R (0.39) ATRJAK2BRD4CSF1RCDK4
SCHEMBL13922511 0.80 MAPKAPK5 (0.42) ATRPIK3CAMTORMAPKAPK5KDM1A
SCHEMBL1685142 0.77 MAPKAPK5 (0.46) ATRJAK2JAK1MAPKAPK5KDM1A
SCHEMBL12618760 0.76 MAPKAPK5 (0.45) ATRJAK2JAK1MAPKAPK5KDM1A
SCHEMBL1685173 0.75 MKNK1 (0.43) PIK3CAMTOR
SCHEMBL3879195 0.74 SYK (0.38) JAK2BRD4CSF1RCDK4CDK6
SCHEMBL1685204 0.74 RIPK1 (0.43) JAK2CDK4CDK6JAK1JAK3
SCHEMBL1685148 0.73 HRH3 (0.38) CDK4CDK6MAPKAPK5CDK1CDK2

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 2 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-20090048245-A1 Imidazolopyridine compounds useful for the treatment of degenerative and inflammatory diseases GALAPAGOS NV (BE) 2009-02-19 US 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 ATR 2844/4885JAK2 1510/4885BRD4 683/4885
US-20090048245-A1 Imidazolopyridine compounds useful for the treatment of degenerative and inflammatory diseases COL2A1, MMP1, COL1A1 ATR 2844/4885JAK2 1510/4885BRD4 683/4885

“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.