SCHEMBL8936320

SCHEMBL8936320

CCCCCCCCCCCCCCCCCCC(=O)Cc1ccc(O)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B3 P37058 7/20 0.59
ESR1 P03372 2/20 0.56
ADRA2A P08913 2/20 0.56
ADORA3 P0DMS8 2/20 0.56
TACR2 P21452 2/20 0.56
SLC6A2 P23975 2/20 0.56
SLC6A4 P31645 2/20 0.56
SLC6A3 Q01959 2/20 0.56
CYP3A4 P08684 2/20 0.56
ALDH1A1 P00352 2/20 0.56
KDM4E B2RXH2 1/20 0.56
LMNA P02545 1/20 0.56
SHBG P04278 1/20 0.56
TP53 P04637 1/20 0.56
HSPD1 P10809 1/20 0.56
ADRB3 P13945 1/20 0.56
HTR2C P28335 1/20 0.56
HSPE1 P61604 1/20 0.56
HIF1A Q16665 1/20 0.56
TST Q16762 1/20 0.56

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
SCHEMBL9362853 1.00 HSD17B3 (0.59) HSD17B3ESR1ADRA2AADORA3TACR2
SCHEMBL9362946 1.00 HSD17B3 (0.59) HSD17B3ESR1ADRA2AADORA3TACR2
SCHEMBL4383629 0.98 HSD17B3 (0.58) HSD17B3ESR1ADRA2AADORA3TACR2
SCHEMBL2565115 0.93 HSD17B3 (0.56) HSD17B3ESR1ADRA2AADORA3TACR2
SCHEMBL18348905 0.86 L3MBTL1 (0.56) CYP3A4ALDH1A1HSD17B10MEN1KMT2A
SCHEMBL8084700 0.86 ALDH1A1 (0.66) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL4463078 0.86 L3MBTL1 (0.56) CYP3A4ALDH1A1HSD17B10MEN1KMT2A
SCHEMBL4451513 0.86 L3MBTL1 (0.56) CYP3A4ALDH1A1HSD17B10MEN1KMT2A
SCHEMBL106914 0.85 CA2 (0.54) HSD17B3ESR1ADRA2AADORA3TACR2
SCHEMBL28635322 0.84 ESR1 (0.65) HSD17B3ESR1ADRA2AADORA3TACR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5512059-A DYEING POLYUREHTANE ELASTIC FIBERS INCLUDING CHLORINE-INDUCED DEGRADATION INHIBITORS THAT DO NO ELUTE OUT TOYO BOSEKI KABUSHIKI KAISHA (JP) 1996-04-30 US disclosed
US-5456960-A A multicomponent yarn comprising a polyurethane elastic fiber containing one or more chlorination resistant inhibitors selected from the group consisting of oxides and hydroxides of magnesium, zinc, aluminum and hydrotalcite TOYO BOSEKI KABUSHIHI KAISHA (JP) 1995-10-10 US disclosed
EP-0489395-B1 Dyed mixed knit fabric and method for its manufacture TOYO BOSEKI (JP) 1995-09-27 EP disclosed
EP-0489395-A1 Dyed mixed knit fabric and method for its manufacture Toyo Boseki Kabushiki Kaisha (JP) 1992-06-10 EP disclosed