SCHEMBL7590468

SCHEMBL7590468

O=C(Oc1c(F)ccc(F)c1F)C1c2ccccc2Nc2cccc(Cl)c21

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PBRM1 Q86U86 4/20 0.36
SMARCA2 P51531 2/20 0.35
SMARCA4 P51532 2/20 0.35
ALOX15 P16050 1/20 0.33
MAPT P10636 4/20 0.33
TP53 P04637 1/20 0.33
HTR5A P47898 3/20 0.32
HTR1A P08908 3/20 0.32
HTR1D P28221 2/20 0.32
HTR2C P28335 2/20 0.32
HTR7 P34969 2/20 0.32
HTR2A P28223 1/20 0.32
HTR3A P46098 1/20 0.32
HTR6 P50406 1/20 0.32
CACNB4 O00305 1/20 0.32
CACNA1A O00555 1/20 0.32
CACNA1G O43497 1/20 0.32
CACNG3 O60359 1/20 0.32
CACNA1F O60840 1/20 0.32
CACNA1H O95180 1/20 0.32

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
SCHEMBL7594082 0.86 MAPT (0.36) MAPTTP53HTR1AALDH1A1L3MBTL1
SCHEMBL7591257 0.78 HDAC4 (0.40) MAPTALDH1A1L3MBTL1MEN1KMT2A
SCHEMBL8686697 0.77 PIN1 (0.32) MAPTTP53ALDH1A1L3MBTL1KMT2A
SCHEMBL8332484 0.73 PIN1 (0.38) MAPTHTR2CHTR2AALDH1A1L3MBTL1
Acridan SCHEMBL6342017 0.71 HDAC4 (0.38) ALOX15MAPTTP53HTR1AHTR1D
SCHEMBL7588820 0.67 HDAC4 (0.40) MAPTL3MBTL1MEN1KMT2A
SCHEMBL29382936 0.67 HDAC4 (0.48) MAPTHTR2CHTR2AHRH1ALDH1A1
SCHEMBL3859311 0.67 HDAC4 (0.48) MAPTHTR2CHTR2AHRH1ALDH1A1
SCHEMBL5803188 0.67 PDE5A (0.37) ALOX15MAPTALDH1A1L3MBTL1SLC6A4
SCHEMBL8688894 0.65 MEN1 (0.35) MAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0778946-B1 NOVEL METHOD AND KITS FOR PRODUCING LIGHT FROM AN ACRIDAN COMPOUND LUMIGEN INC (US) 2002-10-23 EP disclosed
EP-0778946-A4 NOVEL METHOD AND KITS FOR PRODUCING LIGHT FROM AN ACRIDAN COMPOUND LUMIGEN INC (US) 1999-01-27 EP disclosed
US-5670644-A CHEMILUMINESCENT REACTIONS, PEROXIDASE AND PH FOR IMMUNOASSAY LUMIGEN, INC. (US) 1997-09-23 US disclosed
EP-0778946-A1 NOVEL METHOD AND KITS FOR PRODUCING LIGHT FROM AN ACRIDAN COMPOUND LUMIGEN, INC. (US) 1997-06-18 EP disclosed
WO-1996007912-A1 NOVEL METHOD AND KITS FOR PRODUCING LIGHT FROM AN ACRIDAN COMPOUND LUMIGEN, INC. (US) 1996-03-14 WO disclosed