SCHEMBL14337261

SCHEMBL14337261

C=Nc1cc(C(C)(C)C)cc(C(C)(C)C)c1O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.43
CA1 P00915 2/20 0.43
HSP90AA1 P07900 1/20 0.42
SMN1; SMN2 Q16637 4/20 0.42
ALDH1A1 P00352 3/20 0.42
POLB P06746 1/20 0.42
TYR P14679 1/20 0.42
CYP1A2 P05177 3/20 0.41
CYP2C9 P11712 2/20 0.41
CYP2C19 P33261 2/20 0.41
CYP3A4 P08684 1/20 0.41
TSHR P16473 1/20 0.41
GABRA1 P14867 1/20 0.40
GABRB2 P47870 1/20 0.40
HTT P42858 3/20 0.39
NPSR1 Q6W5P4 2/20 0.39
MAPT P10636 2/20 0.38
ALOX15 P16050 2/20 0.38
HPN P05981 1/20 0.38
SIRT5 Q9NXA8 1/20 0.38

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
SCHEMBL22080995 0.81 CA2 (0.43) CA2CA1HSP90AA1SMN1; SMN2ALDH1A1
SCHEMBL14337337 0.81 SMN1; SMN2 (0.63) CA2CA1SMN1; SMN2ALDH1A1POLB
SCHEMBL35141 0.79 CA2 (0.67) CA2CA1HSP90AA1SMN1; SMN2ALDH1A1
SCHEMBL14337334 0.78 CA2 (0.41) CA2CA1HSP90AA1SMN1; SMN2ALDH1A1
SCHEMBL14337333 0.77 HTT (0.40) CA2CA1HSP90AA1SMN1; SMN2ALDH1A1
SCHEMBL28111199 0.77 HSP90AA1 (0.40) CA2CA1HSP90AA1SMN1; SMN2ALDH1A1
SCHEMBL8986512 0.74 CA2 (0.61) CA2CA1HSP90AA1SMN1; SMN2ALDH1A1
SCHEMBL29087487 0.74 TSHR (0.37) CA2CA1HSP90AA1SMN1; SMN2ALDH1A1
SCHEMBL14337388 0.74 TSHR (0.42) CA2CA1HSP90AA1SMN1; SMN2ALDH1A1
SCHEMBL14337272 0.74 HSP90AA1 (0.38) CA2CA1HSP90AA1SMN1; SMN2ALDH1A1

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