SCHEMBL7184444

SCHEMBL7184444

OC(O)C1CC2CCC1C2

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.42
LMNA P02545 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
IDO1 P14902 1/20 0.38
TDO2 P48775 1/20 0.38
POLB P06746 2/20 0.36
ALDH1A1 P00352 3/20 0.34
KMT2A Q03164 3/20 0.34
NPC1 O15118 1/20 0.33
MEN1 O00255 2/20 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
SCHEMBL3821014 0.84 HPGD (0.42) HPGDLMNASMN1; SMN2IDO1TDO2
SCHEMBL16667843 0.83 LMNA (0.39) HPGDLMNASMN1; SMN2IDO1TDO2
SCHEMBL3345713 0.80 HPGD (0.47) HPGDLMNASMN1; SMN2POLBALDH1A1
SCHEMBL27822037 0.80 HPGD (0.40) HPGDLMNASMN1; SMN2IDO1TDO2
SCHEMBL24245343 0.80 HPGD (0.40) HPGDLMNASMN1; SMN2IDO1TDO2
SCHEMBL24906563 0.80 HPGD (0.40) HPGDLMNASMN1; SMN2IDO1TDO2
SCHEMBL14646057 0.80 HPGD (0.47) HPGDLMNASMN1; SMN2POLBALDH1A1
SCHEMBL16004765 0.77 HPGD (0.38) HPGDLMNASMN1; SMN2IDO1TDO2
SCHEMBL14561043 0.77 HPGD (0.45) HPGDLMNASMN1; SMN2IDO1TDO2
SCHEMBL5389485 0.77 HPGD (0.49) HPGDLMNASMN1; SMN2IDO1TDO2

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-102481242-A Use of 1, 3-diols as biocides BASF SE 2012-05-30 CN claimed
EP-3083873-B1 METHODS FOR TREATING A WELL BORE WITHIN AN UNDERGROUND FORMATION COVESTRO LLC (US) 2020-03-25 EP disclosed
US-20150105485-A1 URETHANE FOAM RUBBER AND COMPOSITION FOR FORMING URETHANE FOAM RUBBER YAMAHA CORPORATION (JP) 2015-04-16 US disclosed
EP-2860208-A1 Urethane foam rubber and composition for forming urethane foam rubber YAMAHA CORPORATION (JP) 2015-04-15 EP disclosed
CN-102481242-A Use of 1, 3-diols as biocides BASF SE 2012-05-30 CN disclosed
CN-101479314-B Polyester resin pellet and method for producing same MITSUBISHI CHEM CORP 2011-08-17 CN disclosed
CN-101479314-A Polyester resin pellet and method for producing same MITSUBISHI CHEM CORP (JP) 2009-07-08 CN disclosed
CN-100467513-C Polyethylene terephthalate resin and method for producing polyester resin molded article MITSUBISHI CHEM CORP (JP) 2009-03-11 CN disclosed
CN-1902251-A Polyethylene terephthalate resin and method for producing polyester resin molded article MITSUBISHI CHEM CORP (JP) 2007-01-24 CN disclosed
CN-1271111-C Polyester resin, molded article made of the same, and process for producing polyester resin MITSUBISHI CHEM CORP (JP) 2006-08-23 CN disclosed
CN-1455793-A Polyester resin, molded article made of the same, and process for producing polyester resin MITSUBISHI CHEM CORP (JP) 2003-11-12 CN disclosed
US-20030036620-A1 From an aromatic isocyanate having a structure in which the isocyanate groups are not directly bonded to a benzene ring, an aliphatic isocyanate, an alicyclic isocyanate, and derivatives of these isocyanates. MITSUI CHEMICALS, INC. (JP) 2003-02-20 US disclosed
EP-1167416-A1 URETHANE RESIN COMPOSITION FOR SEALING OPTOELECTRIC CONVERSION DEVICES Mitsui Chemicals, Inc. (JP) 2002-01-02 EP disclosed
CN-1129438-A Hydroformylation process SHELL INT RESEARCH (NL) 1996-08-21 CN disclosed
US-4528126-A 2,4-Dioxa-7,10-methano-spiro [5,5] undecanes and their use in perfumery compositions HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1985-07-09 US disclosed