SCHEMBL3449100

SCHEMBL3449100

CSC(C)(C)[C@@H](NC(=O)O)C(=O)N1CCC(N2Cc3cnc(C)n3C2=O)CC1

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
F10 P00742 5/20 0.47
F2 P00734 3/20 0.47
CCR1 P32246 2/20 0.34
VNN1 O95497 4/20 0.33
CNR2 P34972 2/20 0.32

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
SCHEMBL6014963 0.92 F10 (0.51) F10F2CCR1VNN1CNR2
SCHEMBL3451230 0.90 F10 (0.49) F10F2CCR1VNN1CNR2
SCHEMBL6015017 0.88 F10 (0.47) F10F2CCR1VNN1CNR2
SCHEMBL3451241 0.87 F10 (0.47) F10F2CCR1VNN1CNR2
SCHEMBL3450729 0.86 F10 (0.50) F10F2CCR1
SCHEMBL13123194 0.86 F10 (0.43) F10F2VNN1
SCHEMBL3448969 0.84 F10 (0.47) F10F2
SCHEMBL14541328 0.84 F10 (0.43) F10F2
SCHEMBL6015095 0.83 F10 (0.52) F10F2
SCHEMBL3448456 0.83 F10 (0.42) F10F2

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 1/4885CCR1 2570/4885

“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.