SCHEMBL7516354

SCHEMBL7516354

O=C(c1cccc(Br)c1)c1c(F)c(F)c(F)c(F)c1F

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.55
ALDH1A1 P00352 4/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
TP53 P04637 1/20 0.49
SMN1; SMN2 Q16637 3/20 0.47
HPGD P15428 1/20 0.46
C1S P09871 1/20 0.46
KAT6A Q92794 1/20 0.46
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
MAPT P10636 3/20 0.45
GAA P10253 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
MAOA P21397 1/20 0.45
MAOB P27338 1/20 0.45
NPC1 O15118 2/20 0.45
RAB9A P51151 1/20 0.44
LMNA P02545 1/20 0.44
HTT P42858 1/20 0.44
CYP1A2 P05177 1/20 0.44

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
SCHEMBL30153175 0.83 PARP1 (0.68) PARP1ALDH1A1L3MBTL1TP53SMN1; SMN2
SCHEMBL241785 0.83 PARP1 (0.68) PARP1ALDH1A1L3MBTL1TP53SMN1; SMN2
Hydrochloric Acid SCHEMBL27869733 0.81 PARP1 (0.65) PARP1ALDH1A1L3MBTL1TP53SMN1; SMN2
SCHEMBL9353591 0.81 CES2 (0.59) PARP1ALDH1A1L3MBTL1TP53HPGD
SCHEMBL3838580 0.79 PARP1 (0.63) PARP1ALDH1A1L3MBTL1TP53SMN1; SMN2
SCHEMBL2013121 0.79 PARP1 (0.53) PARP1ALDH1A1L3MBTL1TP53HPGD
SCHEMBL1635669 0.79 PARP1 (0.53) PARP1ALDH1A1L3MBTL1TP53SMN1; SMN2
SCHEMBL40538 0.78 ATM (0.71) PARP1ALDH1A1L3MBTL1TP53SMN1; SMN2
SCHEMBL24169722 0.77 HDAC8 (0.56) PARP1TP53SMN1; SMN2HPGDMEN1
SCHEMBL3838117 0.76 PARP1 (0.59) PARP1ALDH1A1L3MBTL1TP53HPGD

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
WO-2021103298-A1 THERMALLY ACTIVATED DELAYED FLUORESCENT MATERIAL, PREPARATION METHOD THEREFOR AND ELECTROLUMINESCENT DEVICE 武汉华星光电半导体显示技术有限公司 2021-06-03 WO disclosed
EP-1171516-A1 POLYMERS HAVING BACKBONES WITH REACTIVE GROUPS EMPLOYED IN CROSSLINKING AS PRECURSORS TO NANOPOROUS THIN FILM STRUCTURES AlliedSignal Inc. (US) 2002-01-16 EP disclosed
US-6313185-B1 PROVIDING POLYMERIC STRANDS WHEREIN EACH OF THE POLYMERIC STRANDS INCLUDES THERMOLABILE PORTION, AND DEFINES A BACKBONE INCLUDING REACTIVE GROUPS; PROVIDING ENERGY TO CROSSLINK; PROVIDING ENERGY TO PARTIALLY DERGADE THERMOLABILE PORTION HONEYWELL INTERNATIONAL INC. 2001-11-06 US disclosed
WO-2000061667-A1 POLYMERS HAVING BACKBONES WITH REACTIVE GROUPS EMPLOYED IN CROSSLINKING AS PRECURSORS TO NANOPOROUS THIN FILM STRUCTURES ALLIEDSIGNAL INC. (US) 2000-10-19 WO disclosed