SCHEMBL712857

SCHEMBL712857

CCCCCC(O)NC(=O)C(F)(F)F

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.50
MLYCD O95822 1/20 0.43
GPR84 Q9NQS5 7/20 0.43
FAAH O00519 8/20 0.42
CES1 P23141 5/20 0.41
CES2 O00748 2/20 0.41
MEN1 O00255 1/20 0.41
CYP1A2 P05177 1/20 0.41
KMT2A Q03164 1/20 0.41
HSD17B10 Q99714 1/20 0.41
FFAR1 O14842 1/20 0.41
MAPT P10636 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
SCHEMBL28224073 0.98 EPHX1 (0.53) EPHX1MLYCDGPR84FAAHCES1
SCHEMBL4172800 0.94 EPHX1 (0.47) EPHX1MLYCDGPR84FAAHCES1
SCHEMBL28253440 0.86 EPHX1 (0.41) EPHX1MLYCDFAAHCES1CES2
SCHEMBL7045874 0.81 MLYCD (0.57) EPHX1MLYCDFAAHCES1CES2
SCHEMBL570466 0.80 EPHX1 (0.49) EPHX1MLYCDGPR84FAAHCES1
SCHEMBL5273339 0.80 EPHX1 (0.49) EPHX1MLYCDGPR84FAAHCES1
SCHEMBL5270070 0.80 EPHX1 (0.49) EPHX1MLYCDGPR84FAAHCES1
SCHEMBL18349792 0.79 EPHX1 (0.47) EPHX1MLYCDFAAHCES1CES2
SCHEMBL17972439 0.79 EPHX1 (0.51) EPHX1MLYCDGPR84FAAHCES1
SCHEMBL8179038 0.77 NOD1 (0.54) EPHX1GPR84FFAR1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105228451-A Process for preparing prostacyclin compounds having a thiol linker and a pegylated form UNITED THERAPEUTICS CORP 2016-01-06 CN disclosed
US-20140187434-A1 Nucleic Acid Labeling Compounds AFFYMETRIX, INC. (US) 2014-07-03 US disclosed
WO-2014066084-A1 NUCLEIC ACID MODULATORS OF ALPHA2BETA1 NOVAMEDICA LIMITED LIABILITY COMPANY (RU) 2014-05-01 WO disclosed
CN-103608042-A Method for producing PEGylated oligonucleotides REGADO BIOSCIENCES INC 2014-02-26 CN disclosed
US-8497064-B2 Nucleic acid labelling compounds AFFYMETRIX, INC. (US) 2013-07-30 US disclosed
US-20120053336-A1 Nucleic Acid Labelling Compounds AFFYMETRIX, INC. (US) 2012-03-01 US disclosed
US-8076072-B2 Nucleic acid labeling compounds AFFYMETRIX, INC. (US) 2011-12-13 US disclosed
US-8026057-B2 Nucleic acid labeling compounds AFFYMETRIX, INC. (US) 2011-09-27 US disclosed
US-20110082289-A1 Nucleic Acid Labeling Compounds AFFYMETRIC, INC. (US) 2011-04-07 US disclosed
US-7468243-B2 Nucleotide sequence labelling compoumd four use as tool in genetic engineering AFFYMETRIX, INC. (US) 2008-12-23 US disclosed
US-20080287667-A1 Nucleic Acid Labeling Compounds AFFYMETRIX, INC. (US) 2008-11-20 US disclosed
EP-1385829-A4 NUCLEIC ACID LABELING COMPOUNDS AFFYMETRIX INC (US) 2005-10-19 EP disclosed
EP-1385829-A2 NUCLEIC ACID LABELING COMPOUNDS Affymetrix, Inc. (US) 2004-02-04 EP disclosed
US-20020182625-A1 Nucleotide sequence labelling compoumd four use as tool in genetic engineering AFFYMETRIX, INC. 2002-12-05 US disclosed
WO-2002072779-A2 NUCLEIC ACID LABELING COMPOUNDS AFFYMETRIX, INC. (US) 2002-09-19 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110082289-A1 Nucleic Acid Labeling Compounds RNGTT, DUT, FBL EPHX1 3043/4885MLYCD 540/4885GPR84 4031/4885
US-20080287667-A1 Nucleic Acid Labeling Compounds RNGTT, DUT, FBL EPHX1 2239/4885MLYCD 472/4885GPR84 3491/4885
US-20120053336-A1 Nucleic Acid Labelling Compounds RNGTT, DUT, FBL EPHX1 2975/4885MLYCD 475/4885GPR84 3852/4885
US-20020182625-A1 Nucleotide sequence labelling compoumd four use as tool in genetic engineering RNGTT, POLM, RNMT EPHX1 3354/4885MLYCD 176/4885GPR84 4281/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.