SCHEMBL13380441

SCHEMBL13380441

COCCCNC1CCN(c2ccc(N)c(OC)c2)CC1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EGFR P00533 3/20 0.43
SUV39H2 Q9H5I1 3/20 0.41
VCP P55072 2/20 0.39
DPP4 P27487 3/20 0.39
ALDH1A1 P00352 3/20 0.39
HTR4 Q13639 1/20 0.37
SSTR5 P35346 1/20 0.37
GAA P10253 1/20 0.36
LGMN Q99538 1/20 0.36
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL10206165 0.93 EGFR (0.48) EGFRSUV39H2VCPDPP4ALDH1A1
SCHEMBL23259863 0.87 CARM1 (0.45) EGFRSUV39H2VCPDPP4ALDH1A1
SCHEMBL13380517 0.87 DPP4 (0.39) EGFRSUV39H2VCPDPP4ALDH1A1
SCHEMBL517488 0.86 EGFR (0.48) EGFRSUV39H2VCPDPP4ALDH1A1
SCHEMBL13380460 0.80 SUV39H2 (0.44) EGFRSUV39H2DPP4ALDH1A1SSTR5
SCHEMBL10205917 0.79 DPP4 (0.37) EGFRVCPDPP4ALDH1A1SSTR5
SCHEMBL10206184 0.78 DPP4 (0.39) SUV39H2DPP4ALDH1A1HTR4LGMN
SCHEMBL1911920 0.78 DPP4 (0.40) DPP4ALDH1A1LGMNMAPT
SCHEMBL2362547 0.77 DPP4 (0.46) SUV39H2DPP4SSTR5LGMN
SCHEMBL17265199 0.77 ALDH1A1 (0.46) DPP4ALDH1A1GAALGMNLMNA

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
EP-2172461-A1 DI(ARYLAMINO)ARYL COMPOUND Astellas Pharma Inc. (JP) 2010-04-07 EP disclosed