SCHEMBL9056872

SCHEMBL9056872

C=C(CC(=O)O)C(=O)OC(C)OCCCC

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.33
HPGD P15428 1/20 0.32
ALDH1A1 P00352 1/20 0.32
PPARG P37231 2/20 0.32
PPARA Q07869 1/20 0.32
LMNA P02545 2/20 0.31
TP53 P04637 1/20 0.30
HCAR2 Q8TDS4 1/20 0.30
ALOX15 P16050 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL9056862 0.88 LMNA (0.34) TSHRHPGDALDH1A1LMNA
SCHEMBL7088090 0.83 LMNA (0.38) LMNAALOX15HSD17B10
SCHEMBL8398107 0.83 TSHR (0.37) TSHRHPGDALDH1A1PPARGLMNA
SCHEMBL23161032 0.82 TSHR (0.38) TSHRHPGDALDH1A1LMNATP53
SCHEMBL8643739 0.80 PPARG (0.30) PPARGPPARA
SCHEMBL196351 0.80 TSHR (0.49) TSHRHPGDALDH1A1LMNA
SCHEMBL2519756 0.77 FAAH (0.34) ALDH1A1ALOX15HSD17B10
SCHEMBL2119109 0.76 ALOX15 (0.35) TSHRALOX15HSD17B10
SCHEMBL329097 0.76 TSHR (0.52) TSHRHPGDALDH1A1HCAR2
SCHEMBL7086486 0.76 ALOX15 (0.35) TSHRALDH1A1ALOX15HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-8277372-A None JP disclosed
JP-H08277372-A COATING COMPOSITION NIPPON OIL & FATS CO LTD 1996-10-22 JP disclosed
US-4463149-A UNSATURATED POLYSILOXANES POLYMER TECHNOLOGY CORPORATION (US) 1984-07-31 US disclosed