SCHEMBL8638693

SCHEMBL8638693

C=C(CC(=O)O[Si](C)(C)C)C(=O)OCC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.40
GAA P10253 3/20 0.40
TSHR P16473 1/20 0.40
MGAM O43451 1/20 0.40
SI P14410 1/20 0.40
MGAM2 Q2M2H8 1/20 0.40
EGLN1 Q9GZT9 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
MAPT P10636 2/20 0.34
DHODH Q02127 1/20 0.34
CYP2D6 P10635 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
TRPA1 O75762 1/20 0.33
GLO1 Q04760 1/20 0.33
CYP3A4 P08684 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
LMNA P02545 1/20 0.32

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
SCHEMBL3295125 0.84 ALDH1A1 (0.31) ALDH1A1
SCHEMBL8642435 0.82 ALDH1A1 (0.39) ALDH1A1GAATSHRMGAMSI
SCHEMBL60515 0.82 GAA (0.61) ALDH1A1GAATSHRMGAMSI
SCHEMBL28878625 0.80 GAA (0.58) ALDH1A1GAATSHRMGAMSI
SCHEMBL1597247 0.80 MGAM (0.46) ALDH1A1GAATSHRMGAMSI
Hydrochloric Acid SCHEMBL10882428 0.80 GAA (0.58) ALDH1A1GAATSHRMGAMSI
SCHEMBL453324 0.78 GAA (0.68) ALDH1A1GAATSHRMGAMSI
SCHEMBL9485469 0.77 GAA (0.43) ALDH1A1GAATSHRMGAMSI
SCHEMBL8642443 0.76 ADRA1A (0.33) TSHRLMNA
SCHEMBL8641614 0.76 CYP2D6 (0.31) GAACYP2D6NPSR1

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-5851422-A Polymeric material for liquid crystal/polymer composite film, record display medium, and use thereof DAI NIPPON PRINTING CO., LTD. (JP) 1998-12-22 US disclosed
EP-0790289-A1 Polymeric material for liquid crystal/polymer composite film, liquid crystal/polymer composite film, record display medium, and use thereof DAI NIPPON PRINTING CO., LTD. (JP) 1997-08-20 EP disclosed