SCHEMBL4757664

SCHEMBL4757664

Cc1ccc(N/C=C2\C(=O)Nc3ccc(C(=O)c4cccc(C(N)=O)c4)cc32)cc1O

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 1/20 0.46
AKT2 P31751 3/20 0.44
RAF1 P04049 1/20 0.43
TLK2 Q86UE8 4/20 0.42
CDYL2 Q8N8U2 1/20 0.41
CDYL Q9Y232 1/20 0.41
CDY1; CDY1B Q9Y6F8 1/20 0.41
JAK3 P52333 2/20 0.41
GSK3B P49841 3/20 0.39
NTRK1 P04629 1/20 0.39
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CCNB2 O95067 1/20 0.38
CDK1 P06493 1/20 0.38
CCNB1 P14635 1/20 0.38
CCNB3 Q8WWL7 1/20 0.38

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
SCHEMBL3572328 1.00 PDPK1 (0.46) PDPK1AKT2RAF1TLK2CDYL2
SCHEMBL3581636 0.94 PDPK1 (0.43) PDPK1AKT2RAF1TLK2JAK3
SCHEMBL3570002 0.93 AKT2 (0.39) PDPK1AKT2RAF1TLK2CDYL2
SCHEMBL3572331 0.91 LMNA (0.45) PDPK1RAF1TLK2CDYL2CDYL
SCHEMBL4758177 0.89 CDYL2 (0.44) PDPK1AKT2RAF1TLK2CDYL2
SCHEMBL3581378 0.89 CDYL2 (0.44) PDPK1AKT2RAF1TLK2CDYL2
SCHEMBL3581640 0.88 RAF1 (0.42) RAF1TLK2JAK3GSK3BNTRK1
SCHEMBL3584594 0.87 PDPK1 (0.48) PDPK1AKT2RAF1TLK2CDYL2
SCHEMBL3578279 0.87 TGM2 (0.37) PDPK1RAF1TLK2LMNAMAPT
SCHEMBL3579184 0.87 AKT2 (0.44) PDPK1AKT2CDYL2CDYLCDY1; CDY1B

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
EP-1902025-A1 KINASE INHIBITORS Allergan, Inc. (US) 2008-03-26 EP claimed
US-20070032478-A1 Kinase Inhibitors ALLERGAN, INC. 2007-02-08 US claimed
WO-2007008895-A1 KINASE INHIBITORS ALLERGAN, INC. (US) 2007-01-18 WO claimed

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-20070032478-A1 Kinase Inhibitors ABL1, LCK, ERBB2 PDPK1 86/4885AKT2 168/4885RAF1 69/4885

“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.