SCHEMBL6834024

SCHEMBL6834024

C=CC(=O)N(CCCC)C(=O)OCC

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.42
HPGD P15428 1/20 0.42
ZDHHC20 Q5W0Z9 3/20 0.40
ZDHHC2 Q9UIJ5 2/20 0.40
SOAT1 P35610 1/20 0.33
CA12 O43570 2/20 0.32
CA1 P00915 2/20 0.32
CA9 Q16790 2/20 0.32
ATM Q13315 1/20 0.32
FAAH O00519 3/20 0.32
ALDH1A1 P00352 4/20 0.31
MMP1 P03956 1/20 0.31
MMP2 P08253 1/20 0.31
MMP3 P08254 1/20 0.31
MMP8 P22894 1/20 0.31
THRB P10828 1/20 0.30
LMNA P02545 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL27553045 0.89 TSHR (0.36) TSHRHPGDZDHHC20ZDHHC2SOAT1
SCHEMBL10664833 0.83 ZDHHC20 (0.47) TSHRHPGDZDHHC20ZDHHC2CA12
SCHEMBL14142921 0.80 ZDHHC20 (0.42) TSHRHPGDZDHHC20ZDHHC2CA12
SCHEMBL8529029 0.79 ZDHHC20 (0.41) TSHRHPGDZDHHC20ZDHHC2CA12
SCHEMBL22923570 0.78 ZDHHC20 (0.44) TSHRHPGDZDHHC20ZDHHC2CA12
SCHEMBL8743186 0.78 ZDHHC20 (0.44) TSHRHPGDZDHHC20ZDHHC2CA12
SCHEMBL8743344 0.77 ZDHHC20 (0.42) TSHRHPGDZDHHC20ZDHHC2SOAT1
SCHEMBL25108824 0.76 ZDHHC20 (0.57) TSHRHPGDZDHHC20ZDHHC2FAAH
SCHEMBL372729 0.76 ZDHHC20 (0.57) TSHRHPGDZDHHC20ZDHHC2FAAH
SCHEMBL10657941 0.76 ZDHHC20 (0.57) TSHRHPGDZDHHC20ZDHHC2FAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6818717-B2 INCORPORATING INTO PAPER POLYMER OF PERFLUOROALKYL ACRYLATE OR ACRYLAMIDE, SECONDARY OR TERTIARY AMINO OR QUATERNARY AMMONIUM GROUP-CONTAINING ACRYLATE OR ACRYLAMIDE, AND VINYLIDENE CHLORIDE TO IMPART OIL AND GREASE RESISTANCE CIBA SPECIALTY CHEMICALS CORPORATION 2004-11-16 US disclosed
US-20040082745-A1 Fluorinated polymeric paper sizes and soil-release agents MEDPRESENCE CORPORATION 2004-04-29 US disclosed
US-6566470-B2 Copolymerization products of a perfluoroalkyl-substituted (meth)acrylate or methacrylamide, a secondary or tertiary amino or quaternaryammonium group containing (meth)acrylate or (meth)acrylamide, and a vinylidene chloride CIBA SPECIALTY CHEMICALS CORPORATION 2003-05-20 US disclosed
EP-1272539-A1 FLUORINATED POLYMERIC PAPER SIZES AND SOIL-RELEASE AGENTS Ciba Spezialitätenchemie Pfersee GmbH (DE) 2003-01-08 EP disclosed
US-20020096286-A1 Fluorinated polymeric paper sizes and soil-release agents CIBA SPECIALTY CHEMICALS CORP. 2002-07-25 US disclosed
WO-2001079313-A1 FLUORINATED POLYMERIC PAPER SIZES AND SOIL-RELEASE AGENTS Ciba Spezialitätenchemie Pfersee GmbH (DE) 2001-10-25 WO disclosed
EP-0471416-B1 Aqueous dispersions of fluorinated polymers HOECHST AG (DE) 1995-02-08 EP disclosed
US-5240990-A Water and oil repellants for textiles HOECHST AKTIENGESELLSCHAFT (DE) 1993-08-31 US disclosed
EP-0471416-A1 Aqueous dispersions of fluorinated polymers HOECHST AKTIENGESELLSCHAFT (DE) 1992-02-19 EP disclosed
US-4100340-A PERFLUOROALKYLETHYL ACRYLATE-ALKYL ACRYLATE-VINYLIDENE CHLORIDE-ACROYLBUTYLURETHANE HOECHST AKTIENGESELLSCHAFT (DE) 1978-07-11 US disclosed