SCHEMBL7209006

SCHEMBL7209006

C=Cc1ccccc1Br.C=Cc1ccccc1C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.50
TSHR P16473 3/20 0.45
HSD11B1 P28845 3/20 0.38
ACHE P22303 2/20 0.36
KDM4E B2RXH2 2/20 0.34
RAB9A P51151 2/20 0.34
CYP1A2 P05177 2/20 0.34
CYP2C19 P33261 1/20 0.34
APOBEC3A P31941 1/20 0.34
APOBEC3G Q9HC16 1/20 0.34
IKBKB O14920 1/20 0.34
DYRK2 Q92630 1/20 0.34
KMT2A Q03164 3/20 0.34
LMNA P02545 1/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
HTT P42858 1/20 0.34
ATM Q13315 1/20 0.33
LY96 Q9Y6Y9 1/20 0.33
MEN1 O00255 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
SCHEMBL14887 0.87
SCHEMBL678151 0.87 ALDH1A1 (0.56) ALDH1A1TSHRACHEKDM4ERAB9A
SCHEMBL29391686 0.87
SCHEMBL50072 0.87
SCHEMBL29418131 0.87
SCHEMBL10436179 0.85 ALDH1A1 (0.50) ALDH1A1TSHRACHEKDM4ERAB9A
SCHEMBL7547692 0.84 ALDH1A1 (0.54) ALDH1A1TSHRACHEKDM4ERAB9A
Benzene SCHEMBL11895034 0.84 TSHR (0.54) ALDH1A1TSHRACHEKDM4ERAB9A
Ammonia Solution, Strong SCHEMBL2441038 0.84 ALDH1A1 (0.54) ALDH1A1TSHRACHEKDM4ERAB9A
SCHEMBL16109755 0.84 ALDH1A1 (0.54) ALDH1A1TSHRACHEKDM4ERAB9A

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