SCHEMBL4948903

SCHEMBL4948903

C(=Cc1ccccc1)NC1CCCc2ccccc21

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.65
HTT P42858 1/20 0.54
KMT2A Q03164 3/20 0.51
MEN1 O00255 2/20 0.51
TAS1R3 Q7RTX0 3/20 0.49
TAS1R1 Q7RTX1 3/20 0.49
ALDH1A1 P00352 5/20 0.49
EPHX1 P07099 1/20 0.48
LMNA P02545 2/20 0.47
TAS1R2 Q8TE23 2/20 0.46
CYP2D6 P10635 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45

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
SCHEMBL27702720 0.91 SMN1; SMN2 (0.53) SMN1; SMN2HTTKMT2AMEN1TAS1R3
SCHEMBL2115700 0.78 HTT (0.63) SMN1; SMN2HTTKMT2AMEN1TAS1R3
SCHEMBL3532080 0.78 HTT (0.55) SMN1; SMN2HTTKMT2AMEN1TAS1R3
SCHEMBL6001031 0.78 HTT (0.55) SMN1; SMN2HTTKMT2AMEN1TAS1R3
SCHEMBL3532081 0.78 HTT (0.55) SMN1; SMN2HTTKMT2AMEN1TAS1R3
Hydrochloric Acid SCHEMBL7328113 0.77 SMN1; SMN2 (0.56) SMN1; SMN2HTTKMT2AMEN1TAS1R3
SCHEMBL11748233 0.76 HTT (0.60) SMN1; SMN2HTTKMT2AMEN1TAS1R3
SCHEMBL6344102 0.75 HTT (0.59) SMN1; SMN2HTTKMT2AMEN1TAS1R3
SCHEMBL7576444 0.73 SMN1; SMN2 (0.51) SMN1; SMN2HTTKMT2AMEN1
SCHEMBL7576452 0.73 SMN1; SMN2 (0.51) SMN1; SMN2HTTKMT2AMEN1

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
EP-1072669-B1 Organic electroluminescent device SONY CORP (JP) 2008-09-03 EP disclosed
EP-0709364-B1 Tetrahydronaphthylaminostyrene compounds and their use in electrophotographic photoreceptors HODOGAYA CHEMICAL CO LTD (JP) 1999-04-21 EP disclosed
EP-0709364-A1 Tetrahydronaphthylaminostyrene compounds and their use in electrophotographic photoreceptors HODOGAYA CHEMICAL CO LTD (JP) 1996-05-01 EP disclosed