SCHEMBL7124438

SCHEMBL7124438

C(=C/C=C/c1ccccc1)=CCc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.46
MAPK1 P28482 2/20 0.41
ALDH1A1 P00352 2/20 0.41
LMNA P02545 2/20 0.41
TRPA1 O75762 1/20 0.41
ALOX5 P09917 1/20 0.41
MCL1 Q07820 1/20 0.36
POLB P06746 3/20 0.36
RECQL P46063 2/20 0.36
MMP1 P03956 2/20 0.36
MMP2 P08253 2/20 0.36
MMP9 P14780 2/20 0.36
RAB9A P51151 3/20 0.36
NPC1 O15118 3/20 0.35
MAPT P10636 2/20 0.35
MAOA P21397 1/20 0.35
CMA1 P23946 1/20 0.34
GRIN1 Q05586 1/20 0.34
GRIN2B Q13224 1/20 0.34
PLAAT3 P53816 1/20 0.34

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
SCHEMBL7070788 1.00 MAOB (0.46) MAOBMAPK1ALDH1A1LMNATRPA1
SCHEMBL5322088 0.80 MAOB (0.65) MAOBMAPK1ALDH1A1LMNATRPA1
SCHEMBL9521289 0.79 MAOB (0.48) MAOBMAPK1ALDH1A1LMNATRPA1
SCHEMBL8076091 0.79 MAOB (0.48) MAOBMAPK1ALDH1A1LMNATRPA1
SCHEMBL7923061 0.76 MAOB (0.45) MAOBMAPK1ALDH1A1LMNATRPA1
SCHEMBL19178921 0.76 MAOB (0.46) MAOBALDH1A1TRPA1POLBRECQL
SCHEMBL28067063 0.75 MAOB (0.44) MAOBMAPTCMA1CCNB2CDK1
SCHEMBL20211960 0.75 MAOB (0.44) MAOBALDH1A1
SCHEMBL2692076 0.74 MAOB (0.56) MAOBMAPK1ALDH1A1LMNATRPA1
SCHEMBL2692075 0.74 MAOB (0.56) MAOBMAPK1ALDH1A1LMNATRPA1

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-1315707-A1 LIPO- OR AMPHIPHILIC SCINTILLATORS AND THEIR USE IN ASSAYS SENSE PROTEOMIC LIMITED (GB) 2003-06-04 EP disclosed
WO-2002086472-A1 MOLECULAR ROTOR DERIVATIVES AND METHODS OF USE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2002-10-31 WO disclosed
WO-2002014290-A1 LIPO- OR AMPHIPHILIC SCINTILLATORS AND THEIR USE IN ASSAYS SENSE PROTEOMIC LIMITED (GB) 2002-02-21 WO disclosed