SCHEMBL5580145

SCHEMBL5580145

O=C(O)CCC1C=CC=CC1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FFAR3 O14843 1/20 0.31
HDAC3 O15379 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC2 Q92769 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
ALOX5 P09917 1/20 0.31
LMNA P02545 1/20 0.31
ALKBH5 Q6P6C2 1/20 0.31
SUCNR1 Q9BXA5 1/20 0.31
EGLN1 Q9GZT9 1/20 0.31
HTT P42858 1/20 0.30
SIGMAR1 Q99720 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
SCHEMBL23454432 0.87
SCHEMBL10357932 0.82 ALDH1A1 (0.33)
SCHEMBL28729089 0.81 FFAR3 (0.35) FFAR3HDAC3HDAC1HDAC2HDAC8
SCHEMBL6703754 0.79 SLC6A12 (0.32) SIGMAR1
SCHEMBL20825137 0.77 KMT2A (0.32)
SCHEMBL11580408 0.77 LMNA (0.35) LMNAALKBH5SUCNR1EGLN1HTT
SCHEMBL7067973 0.74
SCHEMBL19143724 0.73 GSR (0.37)
SCHEMBL30290918 0.73 GABRR1 (0.37) SIGMAR1
SCHEMBL12438557 0.72 KMT2A (0.40) HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170184963-A1 RESIST COMPOSITION AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2017-06-29 US disclosed
US-9574083-B2 Synergistic effect of multiple mold release additives in polycarbonate based compositions SABIC GLOBAL TECHNOLOGIES B.V. (NL) 2017-02-21 US disclosed
US-20150240073-A1 SYNERGISTIC EFFECT OF MULTIPLE MOLD RELEASE ADDITIVES IN POLYCARBONATE BASED COMPOSITIONS SABIC INNOVATIVE PLASTICS IP B.V. (NL) 2015-08-27 US disclosed
US-20130330799-A1 CRUDE OIL DEGRADING MICROORGANISMS AND METHODS FOR THEIR ENHANCEMENT ALTOGEN LLC (US) 2013-12-12 US disclosed
WO-2007125414-A2 9A-SUBSTITUTED AZALIDES FOR THE TRATMENT OF MALARIA GLAXOSMITHKLINE ISTRAZIVACKI CENTAR ZAGREB D.O.O. (GB) 2007-11-08 WO disclosed
US-20070249018-A1 Reduced overflow metabolism and methods of use ENERGY, UNITED STATES DEPARTMETN OF 2007-10-25 US disclosed
CN-1984881-A Method for producing enantiomeric form of 2, 3-diaminopropionic acid derivatives SANOFI AVENTIS DEUTSCHLAND (DE) 2007-06-20 CN disclosed
EP-1379549-A2 SEQUENCE OF THE PHOTORHABDUS LUMINESCENS STRAIN TT01 GENOME AND USES INSTITUT PASTEUR (FR) 2004-01-14 EP disclosed
WO-2002094867-A2 SEQUENCE OF THE PHOTORHABDUS LUMINESCENS STRAIN TT01 GENOME AND USES INSTITUT PASTEUR (FR) 2002-11-28 WO disclosed
EP-0227948-B1 IMPROVED PHOSPHITE STABILIZER COMPOSITIONS GE SPECIALTY CHEMICALS, INC. (US) 1993-04-07 EP disclosed
EP-0206788-B1 PRODUCTION OF CRYSTALLINE HYDROXYPHENYLPROPIONIC ACID ESTER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1991-08-14 EP disclosed
EP-0227948-A2 Improved phosphite stabilizer compositions GE SPECIALTY CHEMICALS, INC. (US) 1987-07-08 EP disclosed
EP-0206788-A2 Production of crystalline hydroxyphenylpropionic acid ester SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1986-12-30 EP disclosed