SCHEMBL5496525

SCHEMBL5496525

C#Cc1ccc(NCCCCN(C)C)c(NC(=O)c2cc(-c3ccc4nc(N)ncc4c3)ccc2F)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LCK P06239 12/20 0.47
TNKS O95271 1/20 0.45
TNKS2 Q9H2K2 1/20 0.45
KDR P35968 7/20 0.44
TEK Q02763 6/20 0.44
BRAF P15056 1/20 0.38
JAK3 P52333 2/20 0.37
MAPK14 Q16539 1/20 0.37
MTOR P42345 1/20 0.34
PDPK1 O15530 2/20 0.34
CHRNA7 P36544 1/20 0.34
PAICS P22234 1/20 0.34
TMEM97 Q5BJF2 1/20 0.33
SIGMAR1 Q99720 1/20 0.33
JAK2 O60674 1/20 0.33
NTRK1 P04629 1/20 0.33
INSR P06213 1/20 0.33
FES P07332 1/20 0.33
LYN P07948 1/20 0.33
FGR P09769 1/20 0.33

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
SCHEMBL5497753 0.89 LCK (0.50) LCKTNKSTNKS2KDRTEK
SCHEMBL5502261 0.88 LCK (0.49) LCKTNKSTNKS2KDRTEK
SCHEMBL5491403 0.87 LCK (0.60) LCKTNKSTNKS2KDRTEK
SCHEMBL5501869 0.87 LCK (0.52) LCKTNKSTNKS2KDRTEK
SCHEMBL5501658 0.87 LCK (0.59) LCKTNKSTNKS2KDRTEK
SCHEMBL5502217 0.86 LCK (0.47) LCKTNKSTNKS2KDRTEK
SCHEMBL5496681 0.86 LCK (0.53) LCKTNKSTNKS2KDRTEK
SCHEMBL5502207 0.85 LCK (0.61) LCKTNKSTNKS2KDRTEK
SCHEMBL5505516 0.84 LCK (0.54) LCKKDRTEKBRAFJAK3
SCHEMBL5497764 0.79 LCK (0.49) LCKKDRTEKJAK3MAPK14

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-1836174-A2 ARYL NITROGEN-CONTAINING BICYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS AMGEN INC. (US) 2007-09-26 EP claimed
WO-2006039718-A2 ARYL NITROGEN-CONTAINING BICYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS AMGEN INC (US) 2006-04-13 WO claimed
US-20070054916-A1 Aryl nitrogen-containing bicyclic compounds and methods of use AMGEN INC. 2007-03-08 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-20070054916-A1 Aryl nitrogen-containing bicyclic compounds and methods of use MAP3K1, MAP3K5, MAP3K2 LCK 106/4885TNKS 382/4885TNKS2 620/4885

“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.