SCHEMBL11639764

SCHEMBL11639764

CCCCCCCCCCCCCCCC(=S)OC

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 3/20 0.44
CES1 P23141 3/20 0.44
HSP90AA1 P07900 1/20 0.43
POLB P06746 1/20 0.42
POLA1 P09884 1/20 0.42
GPR84 Q9NQS5 7/20 0.42
PPARG P37231 7/20 0.42
PPARD Q03181 7/20 0.42
PPARA Q07869 7/20 0.42
HDAC11 Q96DB2 5/20 0.42
TSHR P16473 4/20 0.42
PTPN1 P18031 3/20 0.42
ALDH1A1 P00352 2/20 0.42
TLR2 O60603 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
FABP4 P15090 2/20 0.42
SLC22A6 Q4U2R8 1/20 0.42
SLC22A8 Q8TCC7 1/20 0.42
MEN1 O00255 1/20 0.42
ESR1 P03372 1/20 0.42

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
SCHEMBL10502779 1.00 CES2 (0.44) CES2CES1HSP90AA1POLBPOLA1
SCHEMBL10504151 1.00 CES2 (0.44) CES2CES1HSP90AA1POLBPOLA1
SCHEMBL10503085 1.00 CES2 (0.44) CES2CES1HSP90AA1POLBPOLA1
SCHEMBL10503240 1.00 CES2 (0.44) CES2CES1HSP90AA1POLBPOLA1
SCHEMBL8003186 1.00 CES2 (0.44) CES2CES1HSP90AA1POLBPOLA1
SCHEMBL11640003 1.00 CES2 (0.44) CES2CES1HSP90AA1POLBPOLA1
SCHEMBL4300390 1.00 CES2 (0.44) CES2CES1HSP90AA1POLBPOLA1
SCHEMBL9695051 1.00 CES2 (0.44) CES2CES1HSP90AA1POLBPOLA1
SCHEMBL10503463 1.00 CES2 (0.44) CES2CES1HSP90AA1POLBPOLA1
SCHEMBL11639940 1.00 CES2 (0.44) CES2CES1HSP90AA1POLBPOLA1

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-4125516-A HEAT STABILIZER, ANTIOXIDANT, DISCOLORATION INHIBITON CIBA-GEIGY CORPORATION (US) 1978-11-14 US disclosed