SCHEMBL6681152

SCHEMBL6681152

COC(=O)C(C)=C(C)C(N)C(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 4/20 0.35
ALDH1A1 P00352 3/20 0.34
MAPT P10636 1/20 0.31
PTGS1 P23219 1/20 0.31

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
Chloromethane SCHEMBL534680 0.77 ALDH1A1 (0.36) ALDH1A1MAPT
SCHEMBL41033 0.76 ALDH1A1 (0.39) DPP4ALDH1A1
Hydrochloric Acid SCHEMBL2533779 0.74 ALDH1A1 (0.37) DPP4ALDH1A1
Acetic Acid SCHEMBL10617960 0.72 ALDH1A1 (0.36) ALDH1A1
SCHEMBL11971797 0.71 DPP4 (0.47) DPP4ALDH1A1MAPTPTGS1
SCHEMBL6676879 0.71 DPP4 (0.35) DPP4ALDH1A1MAPTPTGS1
SCHEMBL446082 0.71 ALDH1A1 (0.34) DPP4ALDH1A1
SCHEMBL18177632 0.70 ALDH1A1 (0.42) ALDH1A1
SCHEMBL20879474 0.70 SMN1; SMN2 (0.42) DPP4ALDH1A1MAPTPTGS1
SCHEMBL500459 0.70 SMN1; SMN2 (0.42) DPP4ALDH1A1MAPTPTGS1

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-2004048506-A1 DYE TRANSFER INHIBITORS FOR LAUNDRY DETERGENTS THE LUBRIZOL CORPORATION (US) 2004-06-10 WO disclosed