SCHEMBL11030640

SCHEMBL11030640

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

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTK2 Q05397 8/20 0.59
▸ JAK2 O60674 5/20 0.59
▸ JAK3 P52333 4/20 0.59
▸ BRD4 O60885 6/20 0.54
▸ MEN1 O00255 2/20 0.49
▸ CYP1A2 P05177 2/20 0.49
▸ CYP3A4 P08684 2/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ ALDH1A1 P00352 1/20 0.49
▸ LMNA P02545 1/20 0.49
▸ MAPK1 P28482 1/20 0.49
▸ HIF1A Q16665 1/20 0.49
▸ CLK4 Q9HAZ1 1/20 0.49
▸ KDM4E B2RXH2 1/20 0.49
▸ CYP2C19 P33261 1/20 0.49
▸ SLC2A1 P11166 1/20 0.48
▸ EGFR P00533 1/20 0.47
▸ LCK P06239 1/20 0.46
▸ FYN P06241 1/20 0.46
▸ FES P07332 1/20 0.46

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
SCHEMBL11030430 0.90 BRD4 (0.63) PTK2JAK2JAK3BRD4SLC2A1
SCHEMBL11031274 0.87 BRD4 (0.46) PTK2JAK2JAK3BRD4ALDH1A1
SCHEMBL11032241 0.87 BRD4 (0.46) PTK2JAK2JAK3BRD4SLC2A1
SCHEMBL11026445 0.87 EGFR (0.51) PTK2JAK2JAK3BRD4MEN1
SCHEMBL11028125 0.87 ALK (0.56) PTK2JAK2JAK3BRD4SLC2A1
SCHEMBL11029787 0.87 JAK2 (0.47) PTK2JAK2JAK3BRD4SLC2A1
SCHEMBL11029599 0.86 MAPKAPK2 (0.58) SLC2A1EGFRCDK4MAPKAPK2BTK
SCHEMBL11026741 0.86 FYN (0.55) SLC2A1EGFRFYNCDK4MAPKAPK2
SCHEMBL11029346 0.86 MAPKAPK2 (0.61) BRD4SLC2A1EGFRCDK4MAPKAPK2
SCHEMBL11031445 0.86 SLC2A1 (0.51) PTK2BRD4SLC2A1EGFRCDK4

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
US-20120190681-A1 PICOLINAMIDE INHIBITORS OF KINASES ABBOTT LABORATORIES (US) 2012-07-26 — — US claimed
WO-2012100135-A1 PICOLINAMIDE INHIBITORS OF KINASES ABBOTT LABORATORIES (US) 2012-07-26 — — WO 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 PTK2 290/4885JAK2 83/4885JAK3 344/4885

“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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