SCHEMBL3789440

SCHEMBL3789440

CC(C)(C)Oc1cccc2ccoc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
ALDH1A1 P00352 2/20 0.41
LMNA P02545 1/20 0.41
HPGD P15428 1/20 0.41
KCNH2 Q12809 1/20 0.38
NPC1 O15118 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
MAPT P10636 1/20 0.36
MAPK1 P28482 1/20 0.36
CASP3 P42574 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
SENP8 Q96LD8 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
SENP6 Q9GZR1 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 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
SCHEMBL595172 0.79 ALDH1A1 (0.58) MEN1KMT2AALDH1A1LMNAHPGD
SCHEMBL23761101 0.77 TMIGD3 (0.33) MEN1KMT2AALDH1A1LMNAHPGD
SCHEMBL11806457 0.77 ALDH1A1 (0.35) MEN1KMT2AALDH1A1LMNAHPGD
SCHEMBL19400648 0.75 ELANE (0.49) MEN1KMT2AALDH1A1LMNAHPGD
SCHEMBL3796715 0.74 ADORA3 (0.49) MEN1KMT2AALDH1A1MAPTTDP1
SCHEMBL3799434 0.74 MCHR1 (0.44) MEN1KMT2AALDH1A1LMNAHPGD
SCHEMBL16283614 0.74 CYP2A6 (0.68) MEN1KMT2AALDH1A1LMNAHPGD
SCHEMBL26597910 0.72 SLC6A2 (0.30) KMT2AHSD17B10SLC6A2SLC6A4
SCHEMBL15495778 0.71 ADORA2A (0.54) MEN1KMT2AALDH1A1LMNAHPGD
SCHEMBL3789397 0.71 MCHR1 (0.46) CYP2A6SLC6A4

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-7645400-B2 Composition containing carbon nanotubes having a coating MITSUBISHI RAYON CO., LTD. (JP) 2010-01-12 US disclosed
US-20090321688-A1 Carbon Nanotube Composition, Composite Having a Coated Film Composed of the Same, and Their Production Methods MITSUBISHI RAYON CO., LTD. (JP) 2009-12-31 US disclosed
US-20060052509-A1 Composition containing carbon nanotubes having coating thereof and process for producing them MITSUBISHI RAYON CO., LTD. (JP) 2006-03-09 US disclosed