SCHEMBL764249

SCHEMBL764249

CNC(C)(C)CC(C)(C)O

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.32
CYP2D6 P10635 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
SCHEMBL12063910 0.79 LMNA (0.38) LMNACYP2D6
SCHEMBL25586262 0.78 ALDH1A1 (0.39) ALDH1A1
SCHEMBL1100489 0.73 LMNA (0.35) LMNACYP2D6
SCHEMBL16579863 0.73 ALDH1A1 (0.35) ALDH1A1
SCHEMBL20434567 0.73 ALDH1A1 (0.35) ALDH1A1
SCHEMBL38006 0.71
SCHEMBL14943806 0.71 LMNA (0.33) LMNACYP2D6
SCHEMBL25920321 0.71 LMNA (0.33) LMNACYP2D6
SCHEMBL10296019 0.71 LMNA (0.33) LMNACYP2D6
SCHEMBL172037 0.69 EPHX1 (0.38)

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-1439174-B1 4-IMIDAZOLIN-2-ONE COMPOUNDS AS p38 MAP KINASE INHIBITORS MITSUBISHI TANABE PHARMA CORP (JP) 2012-03-21 EP disclosed