SCHEMBL4600907

SCHEMBL4600907

C(=Cc1ccccc1-c1noc2ccccc12)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 3/20 0.46
ESR2 Q92731 3/20 0.46
MAOB P27338 1/20 0.44
TRPA1 O75762 2/20 0.43
CASP3 P42574 2/20 0.41
SENP8 Q96LD8 2/20 0.41
SENP7 Q9BQF6 2/20 0.41
SENP6 Q9GZR1 2/20 0.41
NFE2L2 Q16236 2/20 0.40
KDM4E B2RXH2 2/20 0.39
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
AOC3 Q16853 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL6711107 0.79 ESR1 (0.50) ESR1ESR2MAOBSMN1; SMN2AOC3
SCHEMBL4924645 0.77 CYP1A1 (0.46) ESR1ESR2MAOBTRPA1CASP3
SCHEMBL4924654 0.77 CYP1A1 (0.46) ESR1ESR2MAOBTRPA1CASP3
SCHEMBL28399996 0.73 NFE2L2 (0.60) MAOBTRPA1NFE2L2CHAT
SCHEMBL39008 0.73 NFE2L2 (0.60) MAOBTRPA1NFE2L2CHAT
SCHEMBL19031413 0.73 NFE2L2 (0.60) MAOBTRPA1NFE2L2CHAT
SCHEMBL29567711 0.73 NFE2L2 (0.60) MAOBTRPA1NFE2L2CHAT
SCHEMBL30130338 0.73 NFE2L2 (0.60) MAOBTRPA1NFE2L2CHAT
SCHEMBL6712721 0.73 ESR1 (0.41) ESR1ESR2MAOBKDM4EALDH1A1
SCHEMBL6712722 0.73 ESR1 (0.41) ESR1ESR2MAOBKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1848763-B1 MOULDED OBJECT EXHIBITING A POLYCHROMATIC EFFECT, ASSOCIATED LIGHT DEVICE AND RESIN ARKEMA FRANCE (FR) 2008-04-16 EP claimed
EP-1047729-B1 COMPOSITION FOR BLEACHING MECHANICAL PULP DE DONATO FAUSTO (IT) 2003-01-08 EP claimed