SCHEMBL9488607

SCHEMBL9488607

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

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 8/20 0.42
HCAR2 Q8TDS4 1/20 0.34
HPGD P15428 1/20 0.32
LMNA P02545 1/20 0.32
ALDH1A1 P00352 4/20 0.31
TP53 P04637 2/20 0.31
HIF1A Q16665 2/20 0.31
CYP3A4 P08684 1/20 0.31
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL9488597 1.00 TSHR (0.42) TSHRHCAR2HPGDLMNAALDH1A1
SCHEMBL27205415 0.90 TSHR (0.38) TSHRHCAR2
SCHEMBL2184214 0.82 TSHR (0.45) TSHRHCAR2HPGDLMNAALDH1A1
SCHEMBL37396 0.82 TSHR (0.45) TSHRHCAR2HPGDLMNAALDH1A1
SCHEMBL6368708 0.82 TSHR (0.45) TSHRHCAR2HPGDLMNAALDH1A1
SCHEMBL1919847 0.80 TSHR (0.43) TSHRHCAR2HPGDLMNAALDH1A1
SCHEMBL16070994 0.80 TSHR (0.43) TSHRHCAR2HPGDLMNAALDH1A1
SCHEMBL183980 0.80 TSHR (0.43) TSHRHCAR2HPGDLMNAALDH1A1
SCHEMBL1919547 0.80 TSHR (0.43) TSHRHCAR2HPGDLMNAALDH1A1
SCHEMBL10953217 0.80 TSHR (0.43) TSHRHCAR2HPGDLMNAALDH1A1

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-5266441-A Heat diffusible coloring compound, polymerizable binder CANON KABUSHIKI KAISHA (JP) 1993-11-30 US disclosed
EP-0411839-A2 Image forming medium and image forming method CANON KABUSHIKI KAISHA (JP) 1991-02-06 EP disclosed