SCHEMBL987964

SCHEMBL987964

[CH2]CC(CCCC)[S+](C)[O-]

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 2/20 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
SCHEMBL988641 0.93 OPRM1 (0.34) DNM1
SCHEMBL1995923 0.81 DNM1 (0.35) DNM1
SCHEMBL3462815 0.77 FOLH1 (0.31)
SCHEMBL8682846 0.76 LMNA (0.41) DNM1
SCHEMBL11387486 0.76 LMNA (0.41) DNM1
SCHEMBL988639 0.75
SCHEMBL11385298 0.73 LMNA (0.38) DNM1
SCHEMBL27360312 0.71
SCHEMBL4510467 0.70 DNM1 (0.30) DNM1
SCHEMBL4188888 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7865312-B2 Method of non-targeted complex sample analysis PHENOMENOME DISCOVERIES INC. (CA) 2011-01-04 US disclosed
EP-2175389-A2 Method of non-targeted complex sample analysis Yol Bolsum Canada Inc. (CA) 2010-04-14 EP disclosed
US-20080308723-A1 METHOD OF NON-TARGETED COMPLEX SAMPLE ANALYSIS YOL BOLSUM CANADA, INC. (CA) 2008-12-18 US disclosed
US-7349809-B2 Method of non-targeted complex sample analysis YOL BOLSUM CANADA INC. (CA) 2008-03-25 US disclosed
US-20060080042-A1 Method of non-targeted complex sample analysis YOL BOLSUM CANADA, INC (CA) 2006-04-13 US disclosed
US-20040029120-A1 Method of non-targeted complex sample analysis GOLDEN OPPORTUNITIES FUND INC. (CA) 2004-02-12 US disclosed
EP-1255989-A2 METHOD OF NON-TARGETED COMPLEX SAMPLE ANALYSIS Yol Bolsum Canada Inc. (CA) 2002-11-13 EP disclosed
WO-2001057518-A2 METHOD OF NON-TARGETED COMPLEX SAMPLE ANALYSIS YOL BOLSUM CANADA INC. (CA) 2001-08-09 WO disclosed