SCHEMBL6563775

SCHEMBL6563775

CC1(C)CCCC(C)(CCN=C=O)C1

nearest known ligand 0.38

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.38
CYP3A4 P08684 1/20 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
SCHEMBL1526700 0.90 ALDH1A1 (0.36) ALDH1A1CYP3A4
SCHEMBL28285250 0.88 ALDH1A1 (0.36) ALDH1A1CYP3A4
SCHEMBL1081188 0.81 ALDH1A1 (0.51) ALDH1A1CYP3A4
SCHEMBL661926 0.77 ALDH1A1 (0.47) ALDH1A1CYP3A4
SCHEMBL1712651 0.77 ALDH1A1 (0.47) ALDH1A1CYP3A4
Cyanate SCHEMBL20544032 0.75 ALDH1A1 (0.45) ALDH1A1CYP3A4
SCHEMBL7169267 0.73 ALDH1A1 (0.44) ALDH1A1CYP3A4
SCHEMBL3074284 0.73 ALDH1A1 (0.44) ALDH1A1CYP3A4
SCHEMBL5680860 0.72
SCHEMBL2869397 0.71 ALDH1A1 (0.47) ALDH1A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1399516-A1 INTEGRATED METHOD FOR REPAIRING MULITLAYERED COLORED AND/OR EFFECT-PRODUCING PAINT COATINGS BASF Coatings AG (DE) 2004-03-24 EP disclosed
EP-1352034-A1 HARDENABLE POWDER PAINTS, METHOD FOR THE PRODUCTION THEREOF, AND MIXING SYSTEM FOR POWDER PAINTS BASF Coatings AG (DE) 2003-10-15 EP disclosed
WO-2002094955-A1 INTEGRATED METHOD FOR REPAIRING MULITLAYERED COLORED AND/OR EFFECT-PRODUCING PAINT COATINGS BASF COATINGS AG (DE) 2002-11-28 WO disclosed
WO-2002042384-A1 HARDENABLE POWDER PAINTS, METHOD FOR THE PRODUCTION THEREOF, AND MIXING SYSTEM FOR POWDER PAINTS BASF COATINGS AG (DE) 2002-05-30 WO disclosed