SCHEMBL18913612

SCHEMBL18913612

COC(C(C(=O)O)C(C(=O)O)C(C)(C)C)C(C)(C)C

nearest known ligand 0.30

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC1A3 P43003 1/20 0.30
SLC1A2 P43004 1/20 0.30
SLC1A1 P43005 1/20 0.30

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
SCHEMBL23784430 0.81 SLC1A3 (0.31) SLC1A3SLC1A2SLC1A1
SCHEMBL4839860 0.79 ALDH1A1 (0.35)
SCHEMBL20143869 0.79 SLC1A3 (0.30) SLC1A3SLC1A2SLC1A1
SCHEMBL19084206 0.75 TP53 (0.36)
SCHEMBL1604917 0.71 ALDH1A1 (0.39)
SCHEMBL14668832 0.67 SMN1; SMN2 (0.39)
SCHEMBL23583836 0.67 ALDH1A1 (0.36)
SCHEMBL5514917 0.66 TP53 (0.42) SLC1A3SLC1A2SLC1A1
SCHEMBL13542998 0.66 TP53 (0.42) SLC1A3SLC1A2SLC1A1
SCHEMBL22151171 0.66 SLC7A5 (0.39) SLC1A3SLC1A2SLC1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170152600-A1 PLATING CATALYST AND METHOD ROHM & HAAS ELECT MAT (US) 2017-06-01 US disclosed