SCHEMBL14337333

SCHEMBL14337333

CC(C)(C)/C=N\c1cc(C(C)(C)C)cc(C(C)(C)C)c1O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.40
HSP90AA1 P07900 1/20 0.40
CA2 P00918 3/20 0.39
CA1 P00915 2/20 0.39
SMN1; SMN2 Q16637 3/20 0.38
ALDH1A1 P00352 2/20 0.38
POLB P06746 1/20 0.38
TYR P14679 1/20 0.38
CYP1A2 P05177 3/20 0.38
CYP2C9 P11712 2/20 0.38
CYP2C19 P33261 2/20 0.38
CYP3A4 P08684 2/20 0.38
TSHR P16473 2/20 0.38
PTGS2 P35354 4/20 0.37
ALOX5 P09917 3/20 0.37
GABRA1 P14867 1/20 0.36
GABRB2 P47870 1/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36

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
SCHEMBL14337272 0.87 HSP90AA1 (0.38) HTTHSP90AA1CA2CA1SMN1; SMN2
SCHEMBL14337334 0.84 CA2 (0.41) HTTHSP90AA1CA2CA1SMN1; SMN2
SCHEMBL14337526 0.83 SMN1; SMN2 (0.57) HTTCA2CA1SMN1; SMN2ALDH1A1
SCHEMBL14337388 0.80 TSHR (0.42) HTTHSP90AA1CA2CA1SMN1; SMN2
SCHEMBL14337519 0.80 CYP1A2 (0.39) HTTHSP90AA1CA2CA1SMN1; SMN2
SCHEMBL14337340 0.78 NR5A2 (0.38) HTTHSP90AA1CA2CA1SMN1; SMN2
SCHEMBL14337299 0.78 MEN1 (0.39) HTTHSP90AA1CA2CA1SMN1; SMN2
SCHEMBL22080995 0.77 CA2 (0.43) HTTHSP90AA1CA2CA1SMN1; SMN2
SCHEMBL14337261 0.77 CA2 (0.43) HTTHSP90AA1CA2CA1SMN1; SMN2
SCHEMBL14337265 0.76 PTGS2 (0.47) HTTCA2CA1ALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7312284-B2 Process for producing polar olefin copolymer and polar olefin copolymer obtained thereby MITSUI CHEMICALS, INC. (JP) 2007-12-25 US disclosed
US-7312284-B2 Process for producing polar olefin copolymer and polar olefin copolymer obtained thereby MITSUI CHEMICALS, INC. (JP) 2007-12-25 US disclosed
EP-1832609-A2 Process for producing a copolymer of a non-polar olefin and a polar olefin and the copolymer obtained thereby Mitsui Chemicals, Inc. (JP) 2007-09-12 EP disclosed