SCHEMBL3449161

SCHEMBL3449161

CCC(O)(CC)C(NC(=O)OC(C)(C)C)C(=O)N1CCN(N2CN3CN(C)C=C3C2=O)CC1

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MC4R P32245 1/20 0.35
KMT2A Q03164 5/20 0.34
MEN1 O00255 4/20 0.34
MAPK1 P28482 1/20 0.34
HRH2 P25021 10/20 0.34
HRH1 P35367 10/20 0.34
MAPT P10636 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
TGM2 P21980 1/20 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
SCHEMBL3448453 0.91 HRH2 (0.33) MC4RKMT2AMEN1MAPK1HRH2
SCHEMBL3448869 0.90 HRH2 (0.33) MC4RKMT2AMEN1MAPK1HRH2
SCHEMBL3449382 0.89
SCHEMBL3448916 0.88 MAPK1 (0.34) MC4RKMT2AMEN1MAPK1HRH2
SCHEMBL3447727 0.87 MAPK1 (0.33) KMT2AMEN1MAPK1HRH2HRH1
SCHEMBL3449577 0.86 HRH2 (0.36) MC4RKMT2AMEN1MAPK1HRH2
SCHEMBL3447874 0.86 HRH2 (0.38) MC4RKMT2AMEN1MAPK1HRH2
SCHEMBL3449704 0.84 CALCRL (0.37) MC4RKMT2AMEN1MAPK1HRH2
SCHEMBL3448358 0.84 HRH2 (0.36) MC4RKMT2AMEN1MAPK1HRH2
SCHEMBL3449806 0.84 HRH2 (0.37) MC4RKMT2AMEN1MAPK1HRH2

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 MC4R 3894/4885KMT2A 2013/4885MEN1 3128/4885

“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.