SCHEMBL8518926

SCHEMBL8518926

O=C(O)C(O)=CCC(O)CO

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.36
ALDH1A1 P00352 1/20 0.36
OR51E2 Q9H255 1/20 0.35
SLC22A6 Q4U2R8 1/20 0.31
THRB P10828 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
SCHEMBL243508 0.77 CD81 (0.33) LMNAALDH1A1OR51E2
SCHEMBL8624309 0.77 CD81 (0.33) LMNAALDH1A1OR51E2
SCHEMBL288639 0.77 CD81 (0.33) LMNAALDH1A1OR51E2
Water SCHEMBL10629819 0.76 OR51E2 (0.36) LMNAALDH1A1OR51E2
SCHEMBL2338282 0.76 GRIK1 (0.42) LMNAALDH1A1OR51E2SLC22A6
SCHEMBL7391128 0.74 GRIK1 (0.37) LMNAALDH1A1OR51E2
SCHEMBL5972992 0.74 GRIK1 (0.37) LMNAALDH1A1OR51E2
SCHEMBL7391134 0.74 GRIK1 (0.37) LMNAALDH1A1OR51E2
SCHEMBL28114947 0.74 TSHR (0.43) LMNAALDH1A1OR51E2SLC22A6
Methacrylic Acid SCHEMBL1871043 0.71 TGFBR1 (0.34)

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-5973094-A Functional polymers WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 1999-10-26 US disclosed
EP-0794199-A2 Novel functional polymers WAKO PURE CHEMICAL INDUSTRIES, LTD (JP) 1997-09-10 EP disclosed