SCHEMBL28478331

SCHEMBL28478331

CC(C)(O)CON1C(C)(C)CC(OC(=O)CCCCCCCCC(=O)O)CC1(C)C

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 2/20 0.36
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.35
GAA P10253 1/20 0.35
TSHR P16473 3/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
EPHX2 P34913 2/20 0.31

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
Sebacic Acid SCHEMBL26699445 1.00 NAAA (0.36) NAAAKMT2AMEN1GAATSHR
SCHEMBL5159389 0.99 KMT2A (0.36) NAAAKMT2AMEN1GAATSHR
SCHEMBL6794690 0.96 TSHR (0.37) NAAAKMT2AMEN1GAATSHR
SCHEMBL524344 0.95 NAAA (0.39) NAAAKMT2AMEN1GAATSHR
SCHEMBL21582136 0.95 NAAA (0.39) NAAAKMT2AMEN1GAATSHR
SCHEMBL38998 0.94 KMT2A (0.38) NAAAKMT2AMEN1GAATSHR
SCHEMBL3957275 0.91 EPHX2 (0.39) NAAAKMT2AMEN1GAATSHR
SCHEMBL5646805 0.91 KMT2A (0.34) KMT2AMEN1GAATSHR
SCHEMBL39302 0.91 KMT2A (0.38) NAAAKMT2AMEN1GAATSHR
SCHEMBL39244 0.90 NAAA (0.48) NAAAKMT2AMEN1GAASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114008163-A Sealing agent for organic EL display element and organic EL display device 三井化学株式会社 2022-02-01 CN disclosed
CN-111886315-A Sealing material for display element, cured product thereof, frame sealing material for organic EL element, and surface sealing material for organic EL element 三井化学株式会社 2020-11-03 CN disclosed