SCHEMBL8103459

SCHEMBL8103459

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

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.40
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
TDP1 Q9NUW8 1/20 0.33
DPP4 P27487 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
SCHEMBL8529407 0.88 ACACB (0.35) THRBLMNA
SCHEMBL9187270 0.85 USP2 (0.33) THRBALDH1A1LMNA
SCHEMBL4995532 0.81 TSHR (0.35) LMNATDP1DPP4
SCHEMBL16074677 0.80 TSHR (0.33) TDP1DPP4
SCHEMBL28477505 0.76 TSHR (0.35) LMNATDP1DPP4
SCHEMBL224173 0.76 DPP4 (0.31) DPP4
SCHEMBL5675923 0.75 TSHR (0.46) DPP4
SCHEMBL15044071 0.75 TSHR (0.33) TDP1DPP4
SCHEMBL2194664 0.73 DPP4 (0.32) DPP4
SCHEMBL11701461 0.71 CETP (0.40)

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-6057391-A CONTAINING THERMOPLASTIC POLYURETHANE ELASTOMER, PLASTICIZER,BLOCKED POLYISOCYANATE, PIGMENT;INTERIORS OF AUTOMOBILES SANYO CHEMICAL INDUSTRIES, LTD. (JP) 2000-05-02 US disclosed