Allylbenzene

Allylbenzene

SCHEMBL7209008

C=CCc1ccccc1.C=Cc1ccccc1Br

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.40
ALDH1A1 P00352 4/20 0.36
TDP1 Q9NUW8 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
POLB P06746 1/20 0.36
CNR2 P34972 1/20 0.36
TSHR P16473 3/20 0.36
CYP3A4 P08684 2/20 0.36
TP53 P04637 1/20 0.36
ALOX15 P16050 1/20 0.36
ALOX12 P18054 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HSD11B1 P28845 2/20 0.35
EP300 Q09472 2/20 0.35
CARM1 Q86X55 2/20 0.35
MAPT P10636 2/20 0.34
KDM4E B2RXH2 1/20 0.34
HTT P42858 1/20 0.34
CYP1A2 P05177 1/20 0.33

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
Allylbenzene SCHEMBL7056463 0.86 MAOB (0.48) MAOBALDH1A1TDP1MEN1KMT2A
SCHEMBL50072 0.82
SCHEMBL29418131 0.82
Phosphine SCHEMBL8973573 0.80 ALDH1A1 (0.48) ALDH1A1TDP1MEN1KMT2APOLB
Allylbenzene SCHEMBL2478260 0.79 MAOB (0.60) MAOBALDH1A1MEN1KMT2ACNR2
Allylbenzene SCHEMBL10325179 0.79 MAOB (0.60) MAOBALDH1A1MEN1KMT2ACNR2
Allylbenzene SCHEMBL21274 0.79
Allylbenzene SCHEMBL8525966 0.79 CNR2 (0.40) MAOBALDH1A1TDP1MEN1KMT2A
Allylbenzene SCHEMBL7049968 0.78 ALDH1A1 (0.67) MAOBALDH1A1MEN1KMT2ACNR2
Allylbenzene SCHEMBL1356067 0.78 CNR2 (0.42) MAOBALDH1A1TDP1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0688798-B2 MALEIMIDE COPOLYMER AND RESIN COMPOSITION CONTAINING THE SAME MITSUBISHI RAYON CO (JP) 2003-08-27 EP disclosed
US-5948879-A TERPOLYMER OF A MALEIMIDE, VINYLAROMATIC AND ANOTHER MONOMER;MELT PROCESSABILITY; INTRINSIC VISCOSITY OF FROM 0.3 TO 1.5.; YELLOW INDEX OF 30 OR LESS. MITSUBISHI RAYON CO., LTD. (JP) 1999-09-07 US disclosed
EP-0688798-B1 MALEIMIDE COPOLYMER AND RESIN COMPOSITION CONTAINING THE SAME MITSUBISHI RAYON CO (JP) 1999-08-18 EP disclosed
EP-0688798-A1 MALEIMIDE COPOLYMER AND RESIN COMPOSITION CONTAINING THE SAME MITSUBISHI RAYON CO., LTD. (JP) 1995-12-27 EP disclosed