SCHEMBL5328467

SCHEMBL5328467

CCCSCCCC(=O)O

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.71
PTGS1 P23219 1/20 0.55
AKR1B1 P15121 1/20 0.54
TDP1 Q9NUW8 3/20 0.52
HSD17B10 Q99714 3/20 0.52
KMT2A Q03164 2/20 0.52
LMNA P02545 1/20 0.52
GPR84 Q9NQS5 7/20 0.52
PPARG P37231 7/20 0.52
PPARD Q03181 7/20 0.52
PPARA Q07869 7/20 0.52
HDAC11 Q96DB2 5/20 0.52
PTPN1 P18031 3/20 0.52
ALDH1A1 P00352 2/20 0.52
TLR2 O60603 2/20 0.52
FABP4 P15090 2/20 0.52
SLC22A6 Q4U2R8 1/20 0.52
SLC22A8 Q8TCC7 1/20 0.52
MEN1 O00255 1/20 0.52
ESR1 P03372 1/20 0.52

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
SCHEMBL28936022 0.98 TSHR (0.68) TSHRPTGS1AKR1B1TDP1HSD17B10
SCHEMBL723379 0.93 TSHR (0.61) TSHRAKR1B1TDP1HSD17B10KMT2A
SCHEMBL9264051 0.91 GPR84 (0.60) TSHRAKR1B1TDP1HSD17B10KMT2A
SCHEMBL8159471 0.91 GPR84 (0.60) TSHRAKR1B1TDP1HSD17B10KMT2A
SCHEMBL850610 0.91 GPR84 (0.60) TSHRAKR1B1TDP1HSD17B10KMT2A
SCHEMBL7203254 0.91 GPR84 (0.60) TSHRAKR1B1TDP1HSD17B10KMT2A
SCHEMBL4395845 0.91 TSHR (0.71) TSHRPTGS1AKR1B1TDP1HSD17B10
SCHEMBL9260463 0.89 GPR84 (0.58) TSHRAKR1B1TDP1HSD17B10KMT2A
SCHEMBL756105 0.87 TSHR (0.71) TSHRPTGS1AKR1B1TDP1HSD17B10
SCHEMBL3728626 0.86 GPR84 (0.67) TSHRAKR1B1TDP1HSD17B10KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210289794-A1 COMPOSITIONS AND RELATED METHODS FOR AGRICULTURE FLAGSHIP PIONEERING INNOVATIONS V, INC. 2021-09-23 US disclosed
EP-2255829-A2 Pharmaceutical composition for treatment of diseases associated with decrease in bone mass comprising EP4 agonist as active ingredient Ono Pharmaceutical Co., Ltd. (JP) 2010-12-01 EP disclosed
WO-2007147155-A1 POLYOL ESTER COMPOUNDS NOVUS INTERNATIONAL INC. (US) 2007-12-21 WO disclosed
EP-1531672-A2 ANTIMICROBIAL COMPOSITIONS Novus International, Inc. (US) 2005-05-25 EP disclosed
WO-2004019683-A2 ANTIMICROBIAL COMPOSITIONS NOVUS INTERNATIONAL, INC. (US) 2004-03-11 WO disclosed
US-6495152-B2 BIOPOLYMER INCLUDING SULFUR IN THE FORM OF A THIOESTER IN THE POLYMER BACKBONE OR A THIOETHER IN THE POLYMER SIDE CHAINS, PRODUCED BY FERMENTATION OF BACTERIA; USE AS ANTIBACTERIAL COATING, ELECTROLYTE TEPHA, INC. 2002-12-17 US disclosed
US-20020106764-A1 Sulfur containing polyhydroxyalkanoate compositions and method of production TEPHA, INC. 2002-08-08 US disclosed
WO-2002016627-A2 SULFUR CONTAINING POLYHYDROXYALKANOATE COMPOSITIONS AND METHOD OF PRODUCTION TEPHA, INC. (US) 2002-02-28 WO disclosed