SCHEMBL5482766

SCHEMBL5482766

CC(C)CCC(C)NCCNCCNC(C)CCC(C)C

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
OPRK1 P41145 1/20 0.32

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
SCHEMBL14198302 1.00 HTT (0.33) HTTSMN1; SMN2OPRK1
SCHEMBL13995614 0.83 CYP2D6 (0.33) HTTSMN1; SMN2OPRK1
SCHEMBL4746205 0.79 TSHR (0.33) HTTSMN1; SMN2OPRK1
SCHEMBL22926394 0.77 GABRR1 (0.31)
SCHEMBL5040596 0.76 ALDH1A1 (0.34)
SCHEMBL4742297 0.76 ALDH1A1 (0.34)
SCHEMBL4914946 0.76 ALDH1A1 (0.34)
SCHEMBL11114399 0.75 TSHR (0.35)
SCHEMBL22957045 0.75
SCHEMBL14951357 0.74 CYP2D6 (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070022908-A1 Cationic-anionic blends for dynamic surface tension reduction AIR PRODUCTS AND CHEMICALS, INC. 2007-02-01 US disclosed
US-20070022908-A1 Cationic-anionic blends for dynamic surface tension reduction AIR PRODUCTS AND CHEMICALS, INC. 2007-02-01 US disclosed
US-20070022908-A1 Cationic-anionic blends for dynamic surface tension reduction AIR PRODUCTS AND CHEMICALS, INC. 2007-02-01 US disclosed
US-7097705-B2 Cationic-anionic blends for dynamic surface tension reduction AIR PRODUCTS AND CHEMICALS, INC. (US) 2006-08-29 US disclosed
EP-0916392-B1 Surface tension reduction with alkylated polyamines AIR PROD & CHEM (US) 2003-10-29 EP disclosed
US-20030032698-A1 Cationic-anionic blends for dynamic surface tension reduction AIR PRODUCTS AND CHEMICALS, INC. 2003-02-13 US disclosed
US-6268115-B1 SURFACTANTS, WETTING AGENTS AIR PRODUCTS AND CHEMICALS, INC. 2001-07-31 US disclosed
EP-1115033-A1 Use of alkylated polyamines in photoresist developers AIR PRODUCTS AND CHEMICALS, INC. (US) 2001-07-11 EP disclosed
US-5939476-A WATER-BASED COATING, INK, AGRICULTURAL COMPOSITIONS AIR PRODUCTS AND CHEMICALS, INC. (US) 1999-08-17 US disclosed
EP-0916392-A1 Surface tension reduction with alkylated polyamines AIR PRODUCTS AND CHEMICALS, INC. (US) 1999-05-19 EP disclosed