SCHEMBL6521597

SCHEMBL6521597

O=c1cc(-c2ccc(Br)cc2)[nH]n1-c1ccc(Br)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALKBH5 Q6P6C2 3/20 0.57
KMT2A Q03164 9/20 0.54
MAPT P10636 9/20 0.54
MEN1 O00255 8/20 0.54
LMNA P02545 6/20 0.54
HTT P42858 6/20 0.54
RAB9A P51151 4/20 0.54
CYP1A2 P05177 1/20 0.54
CYP3A4 P08684 1/20 0.54
CYP2C9 P11712 1/20 0.54
CYP2C19 P33261 1/20 0.54
CDC7 O00311 1/20 0.51
KDM4E B2RXH2 6/20 0.51
GAA P10253 5/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
NOX4 Q9NPH5 1/20 0.46
NOX1 Q9Y5S8 1/20 0.46
NPC1 O15118 3/20 0.43
TP53 P04637 3/20 0.42
ALDH1A1 P00352 3/20 0.41

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
SCHEMBL23398682 0.82 MAPT (0.55) ALKBH5KMT2AMAPTMEN1LMNA
SCHEMBL2085581 0.78 MAPT (0.69) KMT2AMAPTMEN1LMNAHTT
SCHEMBL8592651 0.76 ALDH1A1 (0.69) ALKBH5KMT2AMAPTMEN1LMNA
SCHEMBL23400761 0.75 MAPT (0.57) ALKBH5KMT2AMAPTMEN1LMNA
SCHEMBL1414675 0.75 MAPT (0.65) KMT2AMAPTMEN1LMNAHTT
SCHEMBL5673453 0.71 MAPT (0.60) ALKBH5KMT2AMAPTMEN1LMNA
SCHEMBL11429334 0.70 MAPT (0.63) KMT2AMAPTMEN1LMNAHTT
SCHEMBL5976501 0.70 ALKBH5 (0.51) ALKBH5KMT2AMAPTMEN1LMNA
SCHEMBL18865500 0.69 ALKBH5 (0.50) ALKBH5KMT2AMAPTMEN1LMNA
SCHEMBL23400828 0.69 ALKBH5 (0.57) ALKBH5KMT2AMAPTMEN1LMNA

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-1155096-B1 FLUORENE COPOLYMERS AND DEVICES MADE THEREFROM DOW GLOBAL TECHNOLOGIES INC (US) 2005-03-09 EP disclosed
US-6353083-B1 CONJUGATED COPOLYMER COMPRISING UNITS DERIVED FROM 9-SUBSTITUTED FLUORENE MONOMERS AND/OR 9,9-DISUBSTITUTED FLUORENE MONOMERS AND TWO DISTINCT RESIDUAL MONOMERIC UNITS THAT HAVE HOLE TRANSPORTING PROPERTIES THE DOW CHEMICAL COMPANY 2002-03-05 US disclosed