SCHEMBL7126608

SCHEMBL7126608

CC(O)CC/C=C/CCCO

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.38
MAPT P10636 1/20 0.38
CNR1 P21554 5/20 0.36
TDP1 Q9NUW8 1/20 0.35
TRPV1 Q8NER1 1/20 0.34
TRPM8 Q7Z2W7 1/20 0.34
DEGS1 O15121 1/20 0.32
ALOX15 P16050 1/20 0.31

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
SCHEMBL7126612 1.00 ALDH1A1 (0.38) ALDH1A1MAPTCNR1TDP1TRPV1
SCHEMBL1657999 0.81 MEN1 (0.42) CNR1
SCHEMBL1657996 0.81 MEN1 (0.42) CNR1
SCHEMBL6748130 0.81 TDP1 (0.35) ALDH1A1MAPTTDP1ALOX15
SCHEMBL7117589 0.80
SCHEMBL7117590 0.80
SCHEMBL31650568 0.79 FAAH (0.50) MAPTCNR1TRPV1ALOX15
SCHEMBL31650510 0.79 FAAH (0.50) MAPTCNR1TRPV1ALOX15
SCHEMBL1657170 0.79 FAAH (0.50) MAPTCNR1TRPV1ALOX15
SCHEMBL1657168 0.79 FAAH (0.50) MAPTCNR1TRPV1ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030153483-A1 Concentrated, stable fabric softening composition TRINH TOAN (US) 2003-08-14 US claimed
EP-0842250-A1 CONCENTRATED, STABLE FABRIC SOFTENING COMPOSITION THE PROCTER & GAMBLE COMPANY (US) 1998-05-20 EP claimed
WO-1997003169-A1 CONCENTRATED, STABLE FABRIC SOFTENING COMPOSITION THE PROCTER & GAMBLE COMPANY (US) 1997-01-30 WO claimed
EP-2599811-A1 Resin composition for laser engraving, flexographic printing plate precursor for laser engraving and process for producing same, and flexographic printing plate and process for making same Fujifilm Corporation (JP) 2013-06-05 EP disclosed
US-20130133539-A1 RESIN COMPOSITION FOR LASER ENGRAVING, FLEXOGRAPHIC PRINTING PLATE PRECURSOR FOR LASER ENGRAVING AND PROCESS FOR PRODUCING SAME, AND FLEXOGRAPHIC PRINTING PLATE AND PROCESS FOR MAKING SAME FUJIFILM CORPORATION (JP) 2013-05-30 US disclosed