SCHEMBL13612672

SCHEMBL13612672

CCC(COC(C)=O)(COC(=O)CS)COC(=O)CS

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.38
HSD17B10 Q99714 2/20 0.38
LMNA P02545 1/20 0.38
TSHR P16473 2/20 0.37
THRB P10828 1/20 0.35

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
SCHEMBL60815 0.92 TSHR (0.42) ALDH1A1HSD17B10TSHRTHRB
SCHEMBL12301078 0.90 HSD17B10 (0.41) ALDH1A1HSD17B10LMNATSHR
SCHEMBL11585849 0.88 TSHR (0.42) ALDH1A1HSD17B10TSHRTHRB
SCHEMBL13398715 0.86 TSHR (0.38) ALDH1A1HSD17B10TSHRTHRB
SCHEMBL13144309 0.86 TSHR (0.38) ALDH1A1HSD17B10TSHRTHRB
SCHEMBL18334182 0.86 THRB (0.43) HSD17B10TSHRTHRB
SCHEMBL540580 0.85 ALDH1A1 (0.50) ALDH1A1HSD17B10LMNATSHRTHRB
SCHEMBL13496531 0.85 ALDH1A1 (0.35) ALDH1A1HSD17B10LMNATSHRTHRB
SCHEMBL10018067 0.85 TSHR (0.37) HSD17B10TSHRTHRB
SCHEMBL12829846 0.84 ALDH1A1 (0.41) ALDH1A1HSD17B10LMNATSHRTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7615114-B2 Ink composition, ink cartridge including the same and ink jet recording apparatus including the ink cartridge SAMSUNG ELECTRONICS CO., LTD. (KR) 2009-11-10 US disclosed
US-20070296785-A1 Ink composition, ink cartridge including the same and ink jet recording apparatus including the ink cartridge SAMSUNG ELECTRONICS CO., LTD. 2007-12-27 US disclosed