SCHEMBL13093503

SCHEMBL13093503

O=C(C1NCC[C@H]1c1ccc(F)c(F)c1)N1CCCC1

nearest known ligand 0.53

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MC4R P32245 8/20 0.47
DPP4 P27487 1/20 0.40
DPP8 Q6V1X1 1/20 0.40
AKT1 P31749 2/20 0.38

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
SCHEMBL13093265 1.00 MC4R (0.47) MC4RDPP4DPP8AKT1
SCHEMBL13093223 0.82 MC4R (0.46) MC4R
SCHEMBL13093222 0.82 MC4R (0.46) MC4R
SCHEMBL13093041 0.81 HDAC2 (0.42) MC4RDPP4DPP8
SCHEMBL13093168 0.81 HDAC2 (0.42) MC4RDPP4DPP8
SCHEMBL13093032 0.80 MC4R (0.44) MC4R
SCHEMBL13093040 0.80 MC4R (0.46) MC4R
SCHEMBL13093311 0.75 MC4R (0.40) MC4R
SCHEMBL13093310 0.74 MEN1 (0.40) MC4R
SCHEMBL13093026 0.72 SLC6A3 (0.50) MC4R

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010123006-A1 PYRROLIDINE COMPOUND 武田薬品工業株式会社 (JP) 2010-10-28 WO disclosed