SCHEMBL10160296

SCHEMBL10160296

O=NC(=O)CCCCC(=O)N=O

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.39
NFKB1 P19838 2/20 0.37
TSHR P16473 1/20 0.37
PMP22 Q01453 1/20 0.37
CES2 O00748 4/20 0.32
CES1 P23141 4/20 0.32
HDAC3 O15379 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC2 Q92769 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
HDAC5 Q9UQL6 1/20 0.32
SLC22A6 Q4U2R8 1/20 0.32
GPR84 Q9NQS5 1/20 0.30
FFAR1 O14842 1/20 0.30
FFAR4 Q5NUL3 1/20 0.30
AKR1B1 P15121 1/20 0.30
CYP2D6 P10635 1/20 0.30
FOLH1 Q04609 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
SCHEMBL18386700 0.97 TSHR (0.42) LMNANFKB1TSHRPMP22CES2
SCHEMBL21467449 0.97 TSHR (0.42) LMNANFKB1TSHRPMP22CES2
SCHEMBL18862808 0.93 SLC22A6 (0.39) LMNANFKB1TSHRPMP22SLC22A6
SCHEMBL14383587 0.88 LMNA (0.61) LMNANFKB1TSHRPMP22SLC22A6
SCHEMBL21116024 0.88 KMT2A (0.37) LMNANFKB1TSHRPMP22CYP2D6
SCHEMBL14402220 0.88
SCHEMBL23516852 0.86
SCHEMBL9651246 0.86
SCHEMBL14302161 0.86 PAOX (0.48) LMNACES2CES1
SCHEMBL16256393 0.86 TSHR (0.63) LMNANFKB1TSHRPMP22SLC22A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170306362-A1 BIOCATALYTIC METHODS TO CONVERT CYCLOHEXANE OXIDATION PROCESS WASTE STREAMS TO USEFUL PRODUCTS INVISTA NORTH AMERICA SARL (US) 2017-10-26 US disclosed
EP-2606084-B1 LIQUID COMPOSITION, RECORDING METHOD, AND RECORDED MATTER RICOH CO LTD (JP) 2017-10-25 EP disclosed
US-9334508-B2 Methods of producing carboxylic acids INVISTA NORTH AMERICA S.A.R.L. (US) 2016-05-10 US disclosed
US-20130224807-A1 METHODS OF PRODUCING CARBOXYLIC ACIDS INVISTA NORTH AMERICA S.A R.L. (US) 2013-08-29 US disclosed
EP-2599814-A1 COMPOUND, RADIATION-SENSITIVE COMPOSITION, AND METHOD FOR FORMING RESIST PATTERN Mitsubishi Gas Chemical Company, Inc. (JP) 2013-06-05 EP disclosed
US-8241879-B2 Biological methods for preparing adipic acid VERDEZYNE, INC. (US) 2012-08-14 US disclosed
US-20120021474-A1 BIOLOGICAL METHODS FOR PREPARING ADIPIC ACID VERDEZYNE, INC. (US) 2012-01-26 US disclosed