SCHEMBL3451344

SCHEMBL3451344

Cc1ncc2n1C(=O)N(N1CCN(C(=O)[C@H](NC(=O)Nc3ccc(Cl)cc3)C(C)C)CC1)C2

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 15/20 0.48
F10 P00742 4/20 0.47
F2 P00734 1/20 0.39
FPR2 P25090 1/20 0.36
KCNH2 Q12809 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
SCHEMBL3449002 0.92 F10 (0.47) CCR1F10F2FPR2
SCHEMBL13108394 0.92 F10 (0.47) CCR1F10F2FPR2
SCHEMBL13123310 0.91 F10 (0.41) CCR1F10F2FPR2
SCHEMBL3450203 0.91 F10 (0.48) CCR1F10F2FPR2KCNH2
SCHEMBL14541411 0.89 F10 (0.41) CCR1F10F2FPR2
SCHEMBL3450303 0.89 F10 (0.47) CCR1F10F2FPR2
SCHEMBL3449908 0.89 F10 (0.47) CCR1F10F2FPR2
SCHEMBL3451874 0.87 F10 (0.47) CCR1F10F2FPR2
SCHEMBL3452169 0.86 F10 (0.46) CCR1F10F2FPR2
SCHEMBL3449335 0.86 F10 (0.46) CCR1F10F2FPR2

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 5 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-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
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 CCR1 2570/4885F10 22/4885F2 1/4885

“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.