SCHEMBL8905674

SCHEMBL8905674

COc1cc(Sc2cc(OC)c(Oc3ccc(N)cc3)c(OC)c2)cc(OC)c1Oc1ccc(N)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.46
TUBB4A P04350 3/20 0.46
TUBB P07437 3/20 0.46
TUBA3C P0DPH7 3/20 0.46
TUBA1B P68363 3/20 0.46
TUBA4A P68366 3/20 0.46
TUBB4B P68371 3/20 0.46
TUBB3 Q13509 3/20 0.46
TUBB2A Q13885 3/20 0.46
TUBB8 Q3ZCM7 3/20 0.46
TUBA3E Q6PEY2 3/20 0.46
TUBA1A Q71U36 3/20 0.46
TUBA1C Q9BQE3 3/20 0.46
TUBB6 Q9BUF5 3/20 0.46
TUBB2B Q9BVA1 3/20 0.46
TUBB1 Q9H4B7 3/20 0.46
TDP1 Q9NUW8 4/20 0.45
MAPK1 P28482 2/20 0.45
ALDH1A1 P00352 6/20 0.44
CYP3A4 P08684 3/20 0.44

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
SCHEMBL8904108 0.95 SMN1; SMN2 (0.46) SMN1; SMN2TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL5604090 0.82 MAOB (0.49) SMN1; SMN2TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL5603440 0.82 ALDH1A1 (0.53) SMN1; SMN2TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL8904017 0.81 SMN1; SMN2 (0.45) SMN1; SMN2TDP1MAPK1ALDH1A1CYP3A4
SCHEMBL8157862 0.79 CYP19A1 (0.56) SMN1; SMN2TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL8578395 0.78 PTGS2 (0.56) SMN1; SMN2TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL8154167 0.78 SMN1; SMN2 (0.45) SMN1; SMN2TDP1MAPK1ALDH1A1CYP3A4
SCHEMBL8153663 0.78 ALDH1A1 (0.49) SMN1; SMN2TDP1MAPK1ALDH1A1CYP3A4
SCHEMBL8579669 0.76 CYP19A1 (0.59) SMN1; SMN2TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL8904104 0.73 SMN1; SMN2 (0.41) SMN1; SMN2TUBB4ATUBBTUBA3CTUBA1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5650463-A Carbon fiber-reinforced polimide resin composition MITSUI TOATSU CHEMICALS, INC. (JP) 1997-07-22 US disclosed
US-5554765-A HEAT RESISTANCE MITSUI TOATSU CHEMICALS, INC. (JP) 1996-09-10 US disclosed
EP-0523240-B1 BISIMIDE COMPOUNDS, POLYIMIDE RESIN COMPOSITION PREPARED THEREFROM, AND CARBON FIBER-REINFORCED POLYIMIDE RESIN COMPOSITION MITSUI TOATSU CHEMICALS (JP) 1996-03-20 EP disclosed
US-5457154-A Melt processability MITSUI TOATSU CHEMICALS, INC. (JP) 1995-10-10 US disclosed
EP-0523240-A1 BISIMIDE COMPOUNDS, POLYIMIDE RESIN COMPOSITION PREPARED THEREFROM, AND CARBON FIBER-REINFORCED POLYIMIDE RESIN COMPOSITION MITSUI TOATSU CHEMICALS, Inc. (JP) 1993-01-20 EP disclosed