SCHEMBL4297986

SCHEMBL4297986

CCCCN(CCCC)C(=S)OCOC(=S)N(CCCC)CCCC

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.50
ALDH2 P05091 1/20 0.50
CA12 O43570 9/20 0.47
CA1 P00915 9/20 0.47
CA9 Q16790 9/20 0.47
CA2 P00918 7/20 0.47
MGLL Q99685 1/20 0.39
MMP1 P03956 1/20 0.38
MMP2 P08253 1/20 0.38
MMP3 P08254 1/20 0.38
MMP8 P22894 1/20 0.38
LMNA P02545 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
SCHEMBL11349971 0.86 ALDH1A1 (0.50) ALDH1A1ALDH2CA12CA1CA9
SCHEMBL965514 0.86 ALDH1A1 (0.50) ALDH1A1ALDH2CA12CA1CA9
SCHEMBL21221409 0.86 CA12 (0.50) ALDH1A1ALDH2CA12CA1CA9
SCHEMBL29083058 0.84 ALDH1A1 (0.48) ALDH1A1ALDH2CA12CA1CA9
SCHEMBL9873801 0.84 ALDH1A1 (0.48) ALDH1A1ALDH2CA12CA1CA9
SCHEMBL30493047 0.84 ALDH1A1 (0.48) ALDH1A1ALDH2CA12CA1CA9
SCHEMBL15173121 0.83 CA12 (0.52) ALDH1A1ALDH2CA12CA1CA9
SCHEMBL15173135 0.79 ALDH1A1 (0.44) ALDH1A1ALDH2CA12CA1CA9
SCHEMBL9320867 0.78 CA12 (0.53) ALDH1A1ALDH2CA12CA1CA9
SCHEMBL8772643 0.78 ALDH1A1 (0.42) ALDH1A1ALDH2CA12CA1CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2003187-B1 USE IN LUBRICANT COMPOSITIONS KYODO YUSHI (JP) 2018-01-31 EP disclosed
US-9376644-B2 Lubricant composition KYODO YUSHI CO., LTD. (JP) 2016-06-28 US disclosed
US-20140303055-A1 Lubricant Composition KYODO YUSHI CO., LTD. (JP) 2014-10-09 US disclosed
EP-2003187-A9 LUBRICANT COMPOSITION KYODO YUSHI CO., LTD. (JP) 2009-02-11 EP disclosed
US-20090016652-A1 LUBRICANT COMPOSITION KYODO YUSHI CO., LTD. (JP) 2009-01-15 US disclosed
EP-2003187-A2 LUBRICANT COMPOSITION KYODO YUSHI CO., LTD. (JP) 2008-12-17 EP disclosed