SCHEMBL4889335

SCHEMBL4889335

CCC(CC)CCCC(O)(CC)CO

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
TDP1 Q9NUW8 1/20 0.32
LMNA P02545 1/20 0.32
CYP3A4 P08684 1/20 0.31
TSHR P16473 1/20 0.31
CA2 P00918 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
SCHEMBL4890337 0.83 ALDH1A1 (0.58) ALDH1A1TDP1LMNACYP3A4TSHR
SCHEMBL17464869 0.80 MEN1 (0.37) ALDH1A1LMNACYP3A4
SCHEMBL4891792 0.79 ALDH1A1 (0.54) ALDH1A1TDP1LMNACYP3A4TSHR
SCHEMBL4894993 0.79 ALDH1A1 (0.34) ALDH1A1
SCHEMBL4884697 0.78 MEN1 (0.30) CYP3A4
SCHEMBL431427 0.77 ALDH1A1 (0.36) ALDH1A1LMNATSHR
SCHEMBL18401217 0.77 SMN1; SMN2 (0.41) ALDH1A1LMNATSHR
SCHEMBL11688192 0.77 ALDH1A1 (0.36) ALDH1A1LMNATSHR
SCHEMBL8073398 0.77 ALDH1A1 (0.32) ALDH1A1
SCHEMBL12492071 0.75 FDPS (0.41) ALDH1A1LMNATSHR

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
US-20080293880-A1 Liquid, Thermally Curable Mixtures, Their Preparation and Use BASF COATINGS AG (DE) 2008-11-27 US claimed