SCHEMBL5451389

SCHEMBL5451389

CN1CCN(c2nccc(N3Cc4[nH]nc(NC(=O)c5cccc(Oc6ccccc6)c5)c4C3)n2)CC1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 7/20 0.49
KIT P10721 6/20 0.49
PRKCB P05771 2/20 0.48
AURKA O14965 11/20 0.46
AURKB Q96GD4 8/20 0.46
PAK4 O96013 2/20 0.46
ABL1 P00519 3/20 0.45
NTRK1 P04629 3/20 0.45
RET P07949 3/20 0.45
FGFR1 P11362 3/20 0.45
CDK2 P24941 3/20 0.45
LIMK1 P53667 3/20 0.45
BCR P11274 2/20 0.45
PLK4 O00444 2/20 0.45
JAK2 O60674 2/20 0.45
MAP4K4 O95819 2/20 0.45
LCK P06239 2/20 0.45
FYN P06241 2/20 0.45
FES P07332 2/20 0.45
LYN P07948 2/20 0.45

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
SCHEMBL5451914 0.92 PAK4 (0.42) FLT3KITPRKCBAURKAAURKB
SCHEMBL5451968 0.91 PRKCB (0.44) FLT3KITPRKCBAURKAPAK4
SCHEMBL5448155 0.91 NPC1 (0.49) FLT3KITPRKCBAURKAPAK4
SCHEMBL5449475 0.89 DGAT1 (0.46) FLT3KITPRKCBAURKAPAK4
SCHEMBL5451386 0.86 FLT3 (0.43) FLT3KITPRKCBPAK4KDR
SCHEMBL5454773 0.86 FLT3 (0.46) FLT3KITPRKCBAURKAAURKB
SCHEMBL5451827 0.85 AURKA (0.48) FLT3KITPRKCBAURKAPAK4
SCHEMBL6233658 0.85 HTR2C (0.43) FLT3KITAURKASRCEGFR
SCHEMBL5448080 0.84 AURKA (0.45) FLT3KITPRKCBAURKAPAK4
SCHEMBL5459482 0.84 AURKA (0.44) FLT3KITPRKCBAURKAAURKB

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-20070037790-A1 Bicyclo-pyrazole derivatives active as kinase inhibitors, process for their preparation and pharmaceutical compositions comprising them PFIZER ITALIA S.R.L. (IT) 2007-02-15 US claimed
US-20070037790-A1 Bicyclo-pyrazole derivatives active as kinase inhibitors, process for their preparation and pharmaceutical compositions comprising them PFIZER ITALIA S.R.L. (IT) 2007-02-15 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-20070037790-A1 Bicyclo-pyrazole derivatives active as kinase inhibitors, process for their preparation and pharmaceutical compositions comprising them MAP3K15, MAP3K7, MAP3K19 FLT3 720/4885KIT 2681/4885PRKCB 41/4885

“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.