SCHEMBL611732

SCHEMBL611732

CCCC/C(=C/O)O/C(=C\O)CCCC

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CES1 P23141 3/20 0.38
CES2 O00748 2/20 0.38
ALDH1A1 P00352 5/20 0.35
TP53 P04637 1/20 0.35
CA1 P00915 1/20 0.33
LMNA P02545 1/20 0.30
TSHR P16473 1/20 0.30
ATM Q13315 1/20 0.30

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
SCHEMBL6810502 1.00 CES1 (0.38) CES1CES2ALDH1A1TP53CA1
SCHEMBL503779 0.90 CES2 (0.42) CES1CES2ALDH1A1TSHR
SCHEMBL1666194 0.90 CES2 (0.42) CES1CES2ALDH1A1TSHR
SCHEMBL1791083 0.81 CES1 (0.39) CES1CES2ALDH1A1TP53CA1
SCHEMBL1791082 0.81 CES1 (0.39) CES1CES2ALDH1A1TP53CA1
SCHEMBL5520436 0.77 CES1 (0.36) CES1CES2ALDH1A1TP53CA1
SCHEMBL731299 0.77 CES1 (0.36) CES1CES2ALDH1A1TP53CA1
SCHEMBL5520433 0.77 CES1 (0.36) CES1CES2ALDH1A1TP53CA1
SCHEMBL7076109 0.75 ALDH1A1 (0.35) CES1CES2ALDH1A1TP53CA1
SCHEMBL7076108 0.75 ALDH1A1 (0.35) CES1CES2ALDH1A1TP53CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8772377-B2 Dispersant comprising copolymer mixture CONSTRUCTION RESEARCH & TECHNOLOGY GMBH (DE) 2014-07-08 US disclosed
US-20120041104-A1 Dispersant Comprising Copolymer Mixture CONSTRUCTION RESEARCH & TECHNOLOGY GMBH (DE) 2012-02-16 US disclosed
US-6127092-A CURABLE REACTION RESIN MIXTURE COMPRISING CATIONICALLY CURABLE MONOMER AND/OR OLIGOMER, INITIATOR HAVING SULFONIUM GROUP SIEMENS AG (DE) 2000-10-03 US disclosed