SCHEMBL6516952

SCHEMBL6516952

O=C(c1ccc(Oc2ccc(Oc3ccccc3)cc2)cc1)c1cccc(Cl)c1Cl

nearest known ligand 0.64

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.56
SRD5A2 P31213 6/20 0.56
LMNA P02545 1/20 0.52
MAPT P10636 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
TSHR P16473 1/20 0.51
BCL2 P10415 3/20 0.51
MCL1 Q07820 3/20 0.51
BAD Q92934 1/20 0.51
PARP10 Q53GL7 1/20 0.49
CYP2C9 P11712 1/20 0.48
POLB P06746 1/20 0.48
NR4A1 P22736 1/20 0.46

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
SCHEMBL9422340 1.00 KMT2A (0.56) KMT2ASRD5A2LMNAMAPTTDP1
SCHEMBL1889955 0.95 KMT2A (0.57) KMT2ASRD5A2LMNAMAPTTDP1
SCHEMBL28033215 0.89 KMT2A (0.71) KMT2ASRD5A2TDP1BCL2MCL1
SCHEMBL10489212 0.85 KMT2A (0.75) KMT2ASRD5A2MAPTTDP1BCL2
SCHEMBL30403796 0.85 TSHR (0.64) KMT2ALMNAMAPTL3MBTL1TSHR
SCHEMBL334531 0.85 TSHR (0.64) KMT2ALMNAMAPTL3MBTL1TSHR
Benzophenone SCHEMBL28174838 0.83 TSHR (0.62) KMT2ALMNAMAPTTDP1L3MBTL1
SCHEMBL31502517 0.83 TSHR (0.62) KMT2ALMNAMAPTL3MBTL1TSHR
Hydrochloric Acid SCHEMBL27343720 0.83 TSHR (0.62) KMT2ALMNAMAPTL3MBTL1TSHR
SCHEMBL10537061 0.83 SRD5A2 (0.71) SRD5A2BCL2MCL1BADPARP10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1245554-B1 Monomer containing electron-withdrawing group and electron-donative group, and copolymer and proton-conductive membrane comprising same JSR CORP (JP) 2005-01-26 EP disclosed