SCHEMBL20184166

SCHEMBL20184166

CN1CCCNCCCNCCC1(C)C

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CXCR4 P61073 3/20 0.36
SOS1 Q07889 1/20 0.36
SOS2 Q07890 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL6961310 0.79 SOS1 (0.45) CXCR4SOS1SOS2
Hydrochloric Acid SCHEMBL7932323 0.76 SOS1 (0.30) CXCR4SOS1SOS2
SCHEMBL2729563 0.75 CXCR4 (0.40) CXCR4SOS1SOS2SMN1; SMN2
SCHEMBL30660182 0.74 SOS1 (0.41) CXCR4SOS1SOS2SMN1; SMN2
SCHEMBL22240454 0.74
Hydrochloric Acid SCHEMBL7934929 0.74 SOS1 (0.31) SOS1SOS2
SCHEMBL766013 0.73
SCHEMBL17609001 0.72 SOS1 (0.64) CXCR4SOS1SOS2
Hydrochloric Acid SCHEMBL7925615 0.72 SOS1 (0.30) CXCR4SOS1SOS2
SCHEMBL7114161 0.71 CXCR4 (0.42) CXCR4SOS1SOS2SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3325596-A1 AUTOMATIC DISHWASHER DETERGENT CONTAINING BLEACHING AGENT AND POLYMERS Henkel AG & Co. KGaA (DE) 2018-05-30 EP claimed
EP-3599268-A1 CLEANING COMPOSITION WITH SURFACTANT GEL PHASE Henkel AG & Co. KGaA (DE) 2020-01-29 EP disclosed
EP-3331856-A1 NOVEL ANIONIC SURFACTANTS AND WASHING AGENTS CONTAINING SAID SURFACTANTS Henkel AG & Co. KGaA (DE) 2018-06-13 EP disclosed
EP-3331855-A1 NEW ANIONIC SURFACTANTS AND DETERGENTS COMPRISING THEM Henkel AG & Co. KGaA (DE) 2018-06-13 EP disclosed