SCHEMBL10031352

SCHEMBL10031352

C=C(C)COCCOCCCOC

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.32
ALDH1A1 P00352 1/20 0.30
MEN1 O00255 1/20 0.30
THRB P10828 1/20 0.30
HTT P42858 1/20 0.30
KMT2A Q03164 1/20 0.30
MAPT P10636 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
SCHEMBL12332782 0.96 CES2 (0.36) CES2ALDH1A1MEN1THRBHTT
SCHEMBL10448464 0.96 CES2 (0.34) CES2ALDH1A1
SCHEMBL30054587 0.91 CES2 (0.37) CES2MEN1THRBHTTKMT2A
SCHEMBL26927712 0.89 CA2 (0.32) THRB
SCHEMBL12541324 0.89 CA2 (0.32) THRB
SCHEMBL11243551 0.89 CES2 (0.38) CES2MEN1THRBHTTKMT2A
SCHEMBL13498373 0.86
SCHEMBL7256155 0.86 CES2 (0.39) CES2
SCHEMBL29488236 0.83 MEN1 (0.35) CES2MEN1THRBKMT2A
SCHEMBL347964 0.83 MEN1 (0.35) CES2MEN1THRBKMT2A

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
US-8323743-B2 Acrylic-fiber finish, acrylic fiber for carbon-fiber production, and carbon-fiber production method MATSUMOTO YUSHI-SEIYAKU CO., LTD. (JP) 2012-12-04 US disclosed
US-20120021125-A1 ACRYLIC-FIBER FINISH, ACRYLIC FIBER FOR CARBON-FIBER PRODUCTION, AND CARBON-FIBER PRODUCTION METHOD MATSUMOTO YUSHI-SEIYAKU CO., LTD. (JP) 2012-01-26 US disclosed