SCHEMBL4887860

SCHEMBL4887860

CCC(C)CCC(CC)CC(O)CO

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.35
TSHR P16473 2/20 0.34
LMNA P02545 3/20 0.32
THRB P10828 1/20 0.32
TRPA1 O75762 1/20 0.32
TDP1 Q9NUW8 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
SCHEMBL4891413 0.83 THRB (0.37) ALDH1A1TSHRLMNATHRBTRPA1
SCHEMBL4891064 0.83 ALDH1A1 (0.40) ALDH1A1TSHRLMNATRPA1TDP1
SCHEMBL3922641 0.80 ALDH1A1 (0.44) ALDH1A1TSHRLMNATHRBTRPA1
SCHEMBL19348914 0.80 ALDH1A1 (0.54) ALDH1A1TSHRLMNATRPA1TDP1
SCHEMBL7765954 0.80 THRB (0.46) ALDH1A1TSHRLMNATHRBTDP1
SCHEMBL16949688 0.79 LMNA (0.44) ALDH1A1TSHRLMNATHRBTRPA1
SCHEMBL27998944 0.79 LMNA (0.44) ALDH1A1TSHRLMNATHRBTRPA1
SCHEMBL2771436 0.78 TSHR (0.36) ALDH1A1TSHR
SCHEMBL411504 0.77
SCHEMBL6700273 0.77 ALDH1A1 (0.44) ALDH1A1TSHRLMNATHRBTRPA1

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