SCHEMBL3448658

SCHEMBL3448658

Cc1ncc2n1C(=O)N(N1CCN(C(=O)C(NC(=O)OC(C)(C)C)C3CC3)CC1)C2

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
F10 P00742 3/20 0.41
AAK1 Q2M2I8 3/20 0.35
HRH2 P25021 3/20 0.35
HRH1 P35367 3/20 0.35
F2 P00734 1/20 0.34
MMP1 P03956 2/20 0.34
KMT2A Q03164 3/20 0.33
MEN1 O00255 2/20 0.33
KDM4D Q6B0I6 1/20 0.31
MAPK1 P28482 2/20 0.31
CTSL P07711 1/20 0.31
MMP2 P08253 1/20 0.31
MMP9 P14780 1/20 0.31
ADAM17 P78536 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31

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
SCHEMBL3448981 0.96 F10 (0.40) F10AAK1HRH2HRH1F2
SCHEMBL3448865 0.88 F10 (0.41) F10HRH2HRH1F2KMT2A
SCHEMBL3448449 0.87 F10 (0.41) F10HRH2HRH1F2KMT2A
SCHEMBL3447722 0.85 F10 (0.40) F10HRH2HRH1F2KMT2A
SCHEMBL3448470 0.85 F10 (0.47) F10AAK1HRH2HRH1F2
SCHEMBL3448912 0.85 F10 (0.40) F10HRH2HRH1F2KMT2A
SCHEMBL3449802 0.85 F10 (0.41) F10HRH2HRH1KMT2AMEN1
SCHEMBL3447872 0.85 F10 (0.41) F10HRH2HRH1F2KMT2A
SCHEMBL3449573 0.84 F10 (0.41) F10HRH2HRH1F2KMT2A
SCHEMBL3449900 0.84 F10 (0.41) F10HRH2HRH1F2KMT2A

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
US-7820673-B2 Urea derivative, process for producing the same, and use TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-10-26 US disclosed
US-20070093501-A1 Urea derivative, process for producing the same, and use TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-04-26 US disclosed
EP-1695961-A1 UREA DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND USE Takeda Pharmaceutical Company Limited (JP) 2006-08-30 EP 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-20070093501-A1 Urea derivative, process for producing the same, and use F2, URB2, F12 F10 22/4885AAK1 4428/4885HRH2 66/4885

“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.