SCHEMBL28032268

SCHEMBL28032268

CC(C)CCC(C(=O)O)C(CCC(C)C)(C(=O)O)S(=O)(=O)O.[NaH]

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC1A3 P43003 1/20 0.31
SLC1A2 P43004 1/20 0.31
SLC1A1 P43005 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
SCHEMBL3136381 0.98 SLC1A3 (0.32) SLC1A3SLC1A2SLC1A1
Ammonia Solution, Strong SCHEMBL28032231 0.97 SLC1A3 (0.31) SLC1A3SLC1A2SLC1A1
SCHEMBL28032714 0.97 SLC1A3 (0.31) SLC1A3SLC1A2SLC1A1
SCHEMBL10717051 0.86 BLM (0.44)
SCHEMBL3144647 0.84 BLM (0.40)
SCHEMBL8326333 0.84 HSPD1 (0.40)
SCHEMBL573634 0.81 BLM (0.37)
SCHEMBL581811 0.81 BLM (0.37)
SCHEMBL317487 0.81 BLM (0.37)
SCHEMBL10317245 0.80 BLM (0.36)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107429199-A Compositions comprising peptidases and biosurfactants 赢创德固赛有限公司 2017-12-01 CN disclosed
CN-105030556-A SURFACTANT COMPOSITIONS AND HIGHLY OLEAGINOUS FORMULATIONS CONTAINING THESE EVONIK INDUSTRIES AG 2015-11-11 CN disclosed
CN-105030555-A SURFACTANT COMPOSITIONS AND HIGHLY OLEAGINOUS FORMULATIONS CONTAINING THESE EVONIK INDUSTRIES AG 2015-11-11 CN disclosed