SCHEMBL3449304

SCHEMBL3449304

Cc1ncc2n1C(=O)N(C1CCN(C(=O)CC(NC(=O)OC(C)(C)C)c3ccccc3)CC1)C2

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
F10 P00742 4/20 0.45
F2 P00734 2/20 0.45
CALCRL Q16602 1/20 0.44
RET P07949 1/20 0.41
ITGB3 P05106 1/20 0.38
ITGA2B P08514 1/20 0.38
CCR5 P51681 1/20 0.36

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
SCHEMBL3448361 0.87 F10 (0.47) F10F2CALCRLITGB3ITGA2B
SCHEMBL3448594 0.86 F10 (0.46) F10F2CALCRL
SCHEMBL3449983 0.85 F10 (0.44) F10RET
SCHEMBL3449255 0.82 F10 (0.51) F10F2CALCRLITGB3ITGA2B
SCHEMBL3449430 0.81 F10 (0.49) F10F2CALCRL
SCHEMBL3448470 0.81 F10 (0.47) F10F2CALCRL
SCHEMBL3449061 0.80 F10 (0.52) F10F2CALCRL
SCHEMBL3447912 0.80 F10 (0.48) F10F2CALCRL
SCHEMBL3448278 0.79 F10 (0.48) F10F2CALCRL
SCHEMBL3448158 0.79 F10 (0.46) F10F2CALCRL

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 22/4885F2 1/4885CALCRL 2629/4885

“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.