SCHEMBL1758831

SCHEMBL1758831

CCCCCCN(CC(F)(F)F)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FAAH O00519 13/20 0.46
CES1 P23141 9/20 0.46
CES2 O00748 5/20 0.46
MEN1 O00255 1/20 0.46
CYP1A2 P05177 1/20 0.46
KMT2A Q03164 1/20 0.46
HSD17B10 Q99714 1/20 0.46
MGLL Q99685 1/20 0.42
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA9 Q16790 1/20 0.41
ZDHHC20 Q5W0Z9 1/20 0.40
PLA2G6 O60733 1/20 0.40

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
SCHEMBL15224778 1.00 FAAH (0.46) FAAHCES1CES2MEN1CYP1A2
SCHEMBL15225307 1.00 FAAH (0.46) FAAHCES1CES2MEN1CYP1A2
SCHEMBL15224878 1.00 FAAH (0.46) FAAHCES1CES2MEN1CYP1A2
SCHEMBL1758795 0.92 CA12 (0.45) FAAHCES1CES2MEN1CYP1A2
SCHEMBL1768632 0.90 FAAH (0.32) FAAHCES1CES2MEN1CYP1A2
SCHEMBL15224890 0.86 FAAH (0.43) FAAHCES1CES2MEN1CYP1A2
SCHEMBL15224874 0.84 FAAH (0.42) FAAHCES1CES2MEN1CYP1A2
SCHEMBL15224857 0.83 FAAH (0.41) FAAHCES1CES2MEN1CYP1A2
SCHEMBL15224877 0.83 FAAH (0.41) FAAHCES1CES2MEN1CYP1A2
SCHEMBL15225060 0.82 CA2 (0.36) FAAHCES1CES2MEN1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2497085-B1 Method for producing a holographic film BAYER IP GMBH (DE) 2014-02-12 EP disclosed
EP-2497084-B1 Selection method for additives in photopolymers BAYER IP GMBH (DE) 2013-12-25 EP disclosed
EP-2497083-B1 Photopolymer formulation with various comonomers BAYER IP GMBH (DE) 2013-12-25 EP disclosed
EP-2497081-B1 Method for producing holographic media BAYER IP GMBH (DE) 2013-10-16 EP disclosed
EP-2497082-B1 Fluorurethane as additive in a photopolymer formulation BAYER IP GMBH (DE) 2013-09-04 EP disclosed
EP-2497082-A1 FLUOROURETHANE AS AN ADDITIVE IN A PHOTOPOLYMER FORMULATION Bayer MaterialScience AG (DE) 2012-09-12 EP disclosed
EP-2497081-A1 METHOD FOR PRODUCING HOLOGRAPHIC MEDIA Bayer MaterialScience AG (DE) 2012-09-12 EP disclosed
EP-2497084-A1 SELECTION METHOD FOR ADDITIVES IN PHOTOPOLYMERS Bayer MaterialScience AG (DE) 2012-09-12 EP disclosed
WO-2011054793-A1 METHOD FOR PRODUCING HOLOGRAPHIC MEDIA BAYER MATERIALSCIENCE AG (DE) 2011-05-12 WO disclosed
WO-2011054796-A1 SELECTION METHOD FOR ADDITIVES IN PHOTOPOLYMERS BAYER MATERIALSCIENCE AG (DE) 2011-05-12 WO disclosed
WO-2011054795-A1 FLUOROURETHANE AS AN ADDITIVE IN A PHOTOPOLYMER FORMULATION BAYER MATERIALSCIENCE AG (DE) 2011-05-12 WO disclosed