SCHEMBL11032241

SCHEMBL11032241

CN1CCN(c2ccc(Nc3cc(-c4cccc(NS(=O)(=O)CC(F)(F)F)c4)cnc3C(N)=O)cc2)CC1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 10/20 0.46
▸ JAK2 O60674 3/20 0.46
▸ PTK2 Q05397 2/20 0.46
▸ JAK3 P52333 1/20 0.46
▸ BTK Q06187 2/20 0.46
▸ FLT3 P36888 2/20 0.45
▸ BRAF P15056 1/20 0.44
▸ SLC2A1 P11166 1/20 0.44
▸ MAPKAPK2 P49137 1/20 0.44
▸ EGFR P00533 1/20 0.43
▸ AURKA O14965 1/20 0.43
▸ FLT1 P17948 1/20 0.43
▸ KDR P35968 1/20 0.43

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
SCHEMBL11030640 0.87 PTK2 (0.59) BRD4JAK2PTK2JAK3BTK
SCHEMBL11030430 0.85 BRD4 (0.63) BRD4JAK2PTK2JAK3BTK
SCHEMBL11026741 0.83 FYN (0.55) BTKSLC2A1MAPKAPK2EGFRAURKA
SCHEMBL11031274 0.82 BRD4 (0.46) BRD4JAK2PTK2JAK3BTK
SCHEMBL11029787 0.82 JAK2 (0.47) BRD4JAK2PTK2JAK3BTK
SCHEMBL11029599 0.81 MAPKAPK2 (0.58) BTKSLC2A1MAPKAPK2EGFRAURKA
SCHEMBL11031445 0.81 SLC2A1 (0.51) BRD4PTK2BTKSLC2A1MAPKAPK2
SCHEMBL11029346 0.81 MAPKAPK2 (0.61) BRD4BTKFLT3SLC2A1MAPKAPK2
SCHEMBL11028800 0.80 BRD4 (0.48) BRD4JAK2PTK2JAK3FLT3
SCHEMBL11027433 0.80 MAPKAPK2 (0.60) JAK2JAK3BTKSLC2A1MAPKAPK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8859546-B2 Picolinamide inhibitors of kinases ABBVIE INC. (US) 2014-10-14 — — US claimed
EP-2665711-A1 PICOLINAMIDE INHIBITORS OF KINASES Abbvie Inc. (US) 2013-11-27 — — EP claimed
WO-2012100135-A1 PICOLINAMIDE INHIBITORS OF KINASES ABBOTT LABORATORIES (US) 2012-07-26 — — WO claimed
US-20120190681-A1 PICOLINAMIDE INHIBITORS OF KINASES ABBOTT LABORATORIES (US) 2012-07-26 — — US claimed
US-8859546-B2 Picolinamide inhibitors of kinases ABBVIE INC. (US) 2014-10-14 — — US disclosed
EP-2665711-A1 PICOLINAMIDE INHIBITORS OF KINASES Abbvie Inc. (US) 2013-11-27 — — EP disclosed
US-20120190681-A1 PICOLINAMIDE INHIBITORS OF KINASES ABBOTT LABORATORIES (US) 2012-07-26 — — US disclosed
WO-2012100135-A1 PICOLINAMIDE INHIBITORS OF KINASES ABBOTT LABORATORIES (US) 2012-07-26 — — 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-20120190681-A1 PICOLINAMIDE INHIBITORS OF KINASES ALK, PKN2, ERBB2 BRD4 1244/4885JAK2 83/4885PTK2 290/4885

“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.

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