SCHEMBL700822

SCHEMBL700822

O=S(=O)=C1C=CC=C(P(C2CCCCC2)C2CCCCC2)C1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL9262245 0.66 ROCK2 (0.32)
SCHEMBL12902859 0.66 ROCK2 (0.32)
SCHEMBL7553731 0.60
SCHEMBL8138741 0.56
SCHEMBL15657725 0.55 ROCK2 (0.40)
SCHEMBL5736962 0.55 HSD11B1 (0.34)
SCHEMBL14905782 0.54 GAA (0.43)
SCHEMBL31268128 0.52 ROCK2 (0.39)
SCHEMBL1315359 0.52 ROCK2 (0.35)
SCHEMBL301129 0.51 ROCK2 (0.44)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8124812-B2 Aldehyde compositions derived from seed oils DOW GLOBAL TECHNOLOGIES LLC (US) 2012-02-28 US disclosed
US-20100298610-A1 ALDEHYDE COMPOSITIONS DERIVED FROM SEED OILS DOW GLOBAL TECHNOLOGIES INC. (US) 2010-11-25 US disclosed
EP-1620387-B1 ALDEHYDE AND ALCOHOL COMPOSITIONS DERIVED FROM SEED OILS DOW GLOBAL TECHNOLOGIES INC (US) 2010-05-19 EP disclosed
US-20100087350-A1 CAPPED POLYESTER POLYOL LUBRICANT COMPOSITION DOW GLOBAL TECHNOLOGIES LLC 2010-04-08 US disclosed
US-20100048753-A1 ALDEHYDE AND ALCOHOL COMPOSITIONS DERIVED FROM SEED OILS DOW GLOBAL TECHNOLOGIES INC. (US) 2010-02-25 US disclosed
EP-2134822-A2 CAPPED POLYESTER POLYOL LUBRICANT COMPOSITION Dow Global Technologies Inc. (US) 2009-12-23 EP disclosed
US-7615658-B2 Aldehyde and alcohol compositions derived from seed oils DOW GLOBAL TECHNOLOGIES, INC. (US) 2009-11-10 US disclosed
EP-2091989-A2 ALDEHYDE AND ALCOHOL COMPOSITIONS DERIVED FROM SEED OILS Dow Global Technologies Inc. (US) 2009-08-26 EP disclosed
WO-2008124265-A2 CAPPED POLYESTER POLYOL LUBRICANT COMPOSITION DOW GLOBAL TECHNOLOGIES, INC. (US) 2008-10-16 WO disclosed
WO-2008073729-A2 ALDEHYDE AND ALCOHOL COMPOSITIONS DERIVED FROM SEED OILS DOW GLOBAL TECHNOLOGIES INC. (US) 2008-06-19 WO disclosed
US-20060193802-A1 Aldehyde and alcohol compositions derived from seed oils DOW GLOBAL TECHNOLOGIES LLC 2006-08-31 US disclosed
EP-1620387-A2 ALDEHYDE AND ALCOHOL COMPOSITIONS DERIVED FROM SEED OILS DOW GLOBAL TECHNOLOGIES INC. (US) 2006-02-01 EP disclosed
WO-2004096744-A2 ALDEHYDE AND ALCOHOL COMPOSITIONS DERIVED FROM SEED OILS DOW GLOBAL TECHNOLGIES INC. (US) 2004-11-11 WO disclosed