SCHEMBL642121

SCHEMBL642121

C=C(C(=O)O)C1CCCCCC1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.50
CES1 P23141 1/20 0.50
HDAC8 Q9BY41 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
TSHR P16473 2/20 0.41
ALDH1A1 P00352 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
POLB P06746 1/20 0.40
SRD5A2 P31213 1/20 0.39
HSD11B1 P28845 3/20 0.37
HPGD P15428 1/20 0.36
RAB9A P51151 1/20 0.36
EPHX1 P07099 2/20 0.35
RECQL P46063 1/20 0.35
HSD11B2 P80365 1/20 0.34
HSD17B10 Q99714 1/20 0.34
SLC6A1 P30531 1/20 0.33
SLC6A11 P48066 1/20 0.33

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
SCHEMBL221713 1.00 CES2 (0.50) CES2CES1HDAC8HDAC6TSHR
SCHEMBL1122749 1.00 CES2 (0.50) CES2CES1HDAC8HDAC6TSHR
SCHEMBL4599659 1.00 CES2 (0.50) CES2CES1HDAC8HDAC6TSHR
SCHEMBL791540 1.00 CES2 (0.50) CES2CES1HDAC8HDAC6TSHR
SCHEMBL399595 0.97 CES2 (0.46) CES2CES1HDAC8HDAC6TSHR
SCHEMBL29207086 0.95 CES2 (0.46) CES2CES1HDAC8HDAC6TSHR
SCHEMBL4962068 0.92
Acrylic Acid SCHEMBL1715031 0.89 LMNA (0.42) CES2CES1HDAC8HDAC6TSHR
SCHEMBL20838334 0.86 SMN1; SMN2 (0.39) CES2CES1TSHRSMN1; SMN2POLB
SCHEMBL26124 0.86

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 66 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0312228-B2 Polymeric additives for use in adhesive compositions ROHM & HAAS (US) 1997-09-17 EP claimed
EP-2616494-B1 METHOD FOR THE PRODUCTION OF ADHESIVE-COATED ARTICLES, ARTICLES OBTAINABLE THEREBY AND THEIR USE COVESTRO DEUTSCHLAND AG (DE) 2019-06-05 EP disclosed
EP-3197953-B1 IMPACT-RESISTANT MOULDING MATERIAL WITH IMPROVED CHARACTERISTIC PROFILE EVONIK ROEHM GMBH (DE) 2018-05-23 EP disclosed
EP-3283540-A1 AQUEOUS POLYURETHANE-POLYACRYLATE DISPERSIONS Covestro Deutschland AG (DE) 2018-02-21 EP disclosed
EP-3197953-A1 IMPACT-RESISTANT MOLDING MATERIAL HAVING AN IMPROVED CHARACTERISTICS PROFILE Evonik Röhm GmbH (DE) 2017-08-02 EP disclosed
EP-3177266-A1 POLYURETHANE UREA SOLUTIONS FOR HAIR-STYLING COMPOSITIONS Covestro Deutschland AG (DE) 2017-06-14 EP disclosed
EP-2786378-B1 HOLOGRAPHIC MEDIUM WITH PROTECTIVE COATING COVESTRO DEUTSCHLAND AG (DE) 2017-05-10 EP disclosed
US-9624387-B2 Aqueous acrylic coating system and method for improving the appearance of grained wood surfaces COVESTRO DEUTSCHLAND AG (DE) 2017-04-18 US disclosed
EP-2704754-B1 HYDROPHILIC POLYURETHANE FOAM WITH LOW VOLUME SWELLING COVESTRO DEUTSCHLAND AG (DE) 2017-03-22 EP disclosed
EP-2978785-B1 IMPACT-RESISTANT PMMA WITH IMPROVED OPTICAL PROPERTIES EVONIK ROEHM GMBH (DE) 2017-03-08 EP disclosed
EP-1572769-A1 METHOD FOR PRODUCING AQUEOUS DISPERSIONS Röhm GmbH & Co. KG (DE) 2005-09-14 EP disclosed
EP-1572768-A2 CORE AND SHELL PARTICLE FOR MODIFYING IMPACT RESISTANCE OF A MOULDABLE POLY(METH)ACRYLATE MATERIAL Röhm GmbH & Co. KG (DE) 2005-09-14 EP disclosed
WO-2004056893-A1 METHOD FOR PRODUCING AQUEOUS DISPERSIONS Röhm GmbH & Co. KG (DE) 2004-07-08 WO disclosed
WO-2004056892-A2 CORE AND SHELL PARTICLE FOR MODIFYING IMPACT RESISTANCE OF A MOULDABLE POLY(METH)ACRYLATE MATERIAL Röhm GmbH & Co. KG (DE) 2004-07-08 WO disclosed
EP-0552603-B1 Soluble polymers BASF AG (DE) 1996-01-10 EP disclosed
EP-0534236-B1 Moulding compositions of polymethylmethacrylate with high heat resistance BASF AG (DE) 1995-12-06 EP disclosed
EP-0552603-A1 Soluble polymers BASF Aktiengesellschaft (DE) 1993-07-28 EP disclosed
EP-0542036-A1 Transparent, impact-modified PMMA-mouldings with improved low temperature impact resistance and high weathering stability BASF Aktiengesellschaft (DE) 1993-05-19 EP disclosed
EP-0534236-A2 Moulding compositions of polymethylmethacrylate with high heat resistance BASF Aktiengesellschaft (DE) 1993-03-31 EP disclosed
US-4067857-A Polyester catalyst system comprising an antimony-containing polycondensation catalyst and an ethylenically unsaturated compound and process employing same STAUFFER CHEMICAL COMPANY (US) 1978-01-10 US disclosed