SCHEMBL9157900

SCHEMBL9157900

COc1ccc(C(Br)C(Br)C(=O)c2ccccc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.64
CYP1A2 P05177 1/20 0.64
L3MBTL1 Q9Y468 2/20 0.55
NPC1 O15118 5/20 0.55
RAB9A P51151 5/20 0.55
MAPT P10636 3/20 0.55
POLB P06746 2/20 0.55
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
CES2 O00748 1/20 0.54
CES1 P23141 1/20 0.54
NPSR1 Q6W5P4 2/20 0.54
PAX8 Q06710 1/20 0.54
ACP3 P15309 1/20 0.49
SMN1; SMN2 Q16637 2/20 0.47
TDP1 Q9NUW8 1/20 0.47
LMNA P02545 2/20 0.46
PLA2G1B P04054 1/20 0.46
ATG4B Q9Y4P1 1/20 0.46
MITF O75030 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
SCHEMBL1180681 0.86 CES2 (0.54) ALDH1A1CYP1A2L3MBTL1NPC1RAB9A
SCHEMBL7017619 0.85 ALDH1A1 (0.57) ALDH1A1CYP1A2L3MBTL1NPC1RAB9A
SCHEMBL978025 0.84 TDP1 (0.57) ALDH1A1CYP1A2L3MBTL1NPC1RAB9A
SCHEMBL11056951 0.83 CES2 (0.48) ALDH1A1CYP1A2L3MBTL1NPC1RAB9A
SCHEMBL28795688 0.83 MEN1 (0.50) ALDH1A1CYP1A2L3MBTL1NPC1RAB9A
SCHEMBL2921669 0.81 L3MBTL1 (0.66) ALDH1A1CYP1A2L3MBTL1NPC1RAB9A
SCHEMBL1180520 0.80 ALDH1A1 (0.59) ALDH1A1CYP1A2L3MBTL1NPC1RAB9A
SCHEMBL1755267 0.80 L3MBTL1 (0.58) ALDH1A1CYP1A2L3MBTL1NPC1RAB9A
SCHEMBL28945734 0.80 LMNA (0.46) ALDH1A1CYP1A2L3MBTL1NPC1RAB9A
SCHEMBL2528895 0.80 LMNA (0.67) ALDH1A1CYP1A2L3MBTL1NPC1RAB9A

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
US-5407783-A Thermostability, shelf life E. I. DU PONT DE NEMOURS AND COMPANY (US) 1995-04-18 US disclosed