SCHEMBL13746285

SCHEMBL13746285

CN(C)c1ccc(-c2cnc3c(c2)c(-c2cccc(F)c2)cn3OOSc2ccccc2)cc1

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ KIT P10721 3/20 0.34
▸ MAPK8 P45983 1/20 0.34
▸ MAPK9 P45984 1/20 0.34
▸ MAPK10 P53779 1/20 0.34
▸ PTPN11 Q06124 6/20 0.32
▸ GSK3B P49841 1/20 0.32
▸ FYN P06241 2/20 0.31
▸ PDGFRB P09619 1/20 0.31
▸ PDGFRA P16234 1/20 0.31
▸ NT5E P21589 1/20 0.30
▸ GRIN1 Q05586 1/20 0.30
▸ GRIN2B Q13224 1/20 0.30

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
SCHEMBL13746292 0.92 GSK3B (0.34) KITPTPN11GSK3BFYNNT5E
SCHEMBL13745686 0.85 KDR (0.35) PTPN11GSK3B
SCHEMBL13745903 0.82 MAPK8 (0.37) KITMAPK8MAPK9MAPK10GSK3B
SCHEMBL13746324 0.81 KDR (0.44) KITPTPN11
SCHEMBL13609303 0.80 ALDH1A1 (0.38) MAPK8MAPK9MAPK10PTPN11GSK3B
SCHEMBL13745855 0.80 CAMKK2 (0.36) FYN
SCHEMBL13745732 0.80 KDR (0.49) PTPN11
SCHEMBL13745690 0.80 GSK3B (0.34) GSK3B
SCHEMBL13609212 0.79 AAK1 (0.38) MAPK8MAPK9MAPK10GSK3BPDGFRB
SCHEMBL13745703 0.79 KDR (0.38) PTPN11GSK3B

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-20090215771-A1 JNK INHIBITORS GRACZYK PIOTR 2009-08-27 — — US disclosed
US-7432375-B2 JNK inhibitors EISAI R & D MANAGEMENT CO., LTD. (JP) 2008-10-07 — — 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 (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-20090215771-A1 JNK INHIBITORS MAPKAPK2, MAPK1, MAPKAPK3 KIT 3148/4885MAPK8 50/4885MAPK9 43/4885

“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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