SCHEMBL6945379

SCHEMBL6945379

OCC(Oc1ccccc1)C1CNCCN1

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.38
SLC6A2 P23975 11/20 0.35
SLC6A4 P31645 11/20 0.35
SLC6A3 Q01959 9/20 0.35
KCNH2 Q12809 3/20 0.34
CYP2D6 P10635 2/20 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
SCHEMBL7280300 0.75 ADRA2A (0.35) LTA4HSLC6A2SLC6A4SLC6A3KCNH2
SCHEMBL6451097 0.74 MAN2A1 (0.37) SLC6A2SLC6A4SLC6A3
Hydrochloric Acid SCHEMBL27861282 0.71 LTA4H (0.40) LTA4HSLC6A2SLC6A4SLC6A3KCNH2
SCHEMBL20142304 0.68 GBA1 (0.46) SLC6A2SLC6A4SLC6A3
SCHEMBL20142303 0.68 GBA1 (0.46) SLC6A2SLC6A4SLC6A3
SCHEMBL7007764 0.67 SLC6A2 (0.37) SLC6A2SLC6A4SLC6A3
Hydrochloric Acid SCHEMBL27861280 0.67 LTA4H (0.40) LTA4HSLC6A2SLC6A4SLC6A3
Hydrochloric Acid SCHEMBL6336901 0.66 SLC6A2 (0.36) SLC6A2SLC6A4SLC6A3
Hydrochloric Acid SCHEMBL6541046 0.66 SLC6A2 (0.36) SLC6A2SLC6A4SLC6A3
Hydrochloric Acid SCHEMBL6540298 0.66 SLC6A2 (0.36) SLC6A2SLC6A4SLC6A3

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
EP-1325107-A1 LAUNDERING AID FOR PREVENTING DYE TRANSFER The Procter & Gamble Company (US) 2003-07-09 EP disclosed
WO-2002033040-A1 LAUNDERING AID FOR PREVENTING DYE TRANSFER THE PROCTER & GAMBLE COMPANY (US) 2002-04-25 WO disclosed