SCHEMBL4887216

SCHEMBL4887216

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

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.50
THRB P10828 1/20 0.32
ALDH1A1 P00352 2/20 0.32
TSHR P16473 2/20 0.31
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL17464866 0.83 LMNA (0.43) LMNATHRBALDH1A1TSHRTDP1
SCHEMBL4890350 0.82 LMNA (0.46) LMNATHRBALDH1A1TSHRTDP1
SCHEMBL20577887 0.80 LMNA (0.50) LMNAALDH1A1TSHRTDP1
SCHEMBL11040683 0.78 THRB (0.53) LMNATHRBALDH1A1TSHRTDP1
SCHEMBL19738979 0.78 THRB (0.53) LMNATHRBALDH1A1TSHRTDP1
SCHEMBL619867 0.78 TSHR (0.47) LMNATHRBALDH1A1TSHR
SCHEMBL45286 0.78 LMNA (0.55) LMNAALDH1A1TSHRTDP1
SCHEMBL4754377 0.78 LMNA (0.55) LMNAALDH1A1TSHRTDP1
SCHEMBL29093054 0.78 TSHR (0.47) LMNATHRBALDH1A1TSHR
SCHEMBL29093233 0.78 TSHR (0.47) LMNATHRBALDH1A1TSHR

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