SCHEMBL3550672

SCHEMBL3550672

COC(=O)c1cccn2c(-c3ccnc(S(C)(=O)=O)n3)cnc12

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DRD1 P21728 1/20 0.45
MAPK9 P45984 9/20 0.42
DYRK1A Q13627 2/20 0.42
DYRK2 Q92630 1/20 0.42
DYRK1B Q9Y463 1/20 0.42
SDHB P21912 1/20 0.41
MAPK8 P45983 5/20 0.40
MKNK1 Q9BUB5 1/20 0.39
FLT3 P36888 2/20 0.38
EGFR P00533 3/20 0.36
AURKA O14965 1/20 0.36
PTK2 Q05397 1/20 0.36
KCNH2 Q12809 1/20 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
SCHEMBL3554702 0.89 MAPK9 (0.43) MAPK9DYRK1ADYRK2DYRK1BMAPK8
SCHEMBL3549513 0.82 DYRK1A (0.46) DRD1MAPK9DYRK1ADYRK2DYRK1B
SCHEMBL3557012 0.76 CAMK2D (0.47) DRD1MAPK9DYRK1AMAPK8FLT3
SCHEMBL3548686 0.73 DYRK1A (0.62) MAPK9DYRK1ADYRK2DYRK1BMAPK8
SCHEMBL14561140 0.73 BRAF (0.46) SDHBMAPK8FLT3EGFRKCNH2
SCHEMBL20294300 0.72 DRD1 (0.45) DRD1MKNK1
SCHEMBL20294474 0.70 ALDH1A1 (0.52) DRD1MKNK1
SCHEMBL1880365 0.70 NPSR1 (0.44) DRD1MKNK1
SCHEMBL27927010 0.69 DYRK1A (0.41) MAPK9DYRK1ADYRK2DYRK1BMAPK8
SCHEMBL12272611 0.69 DYRK1A (0.38) MAPK9DYRK1ADYRK2DYRK1BMAPK8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7718801-B2 Substituted imidazole derivative BANYU PHARMACEUTICAL CO., LTD. (JP) 2010-05-18 US disclosed
US-20080070894-A1 Novel Substituted Imidazole Derivative MSD K.K. (JP) 2008-03-20 US disclosed
EP-1790650-A1 NOVEL SUBSTITUTED IMIDAZOLE DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 2007-05-30 EP 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-20080070894-A1 Novel Substituted Imidazole Derivative PLK1, CDK1, CDK11A DRD1 3018/4885MAPK9 156/4885DYRK1A 483/4885

“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.