SCHEMBL8529161

SCHEMBL8529161

[CH2]Cc1ccccc1-c1ccc(OC)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 2/20 0.55
ABCB1 P08183 2/20 0.55
BCR P11274 2/20 0.55
HDAC4 P56524 1/20 0.49
HDAC2 Q92769 1/20 0.49
HDAC8 Q9BY41 1/20 0.49
HTR7 P34969 2/20 0.48
FFAR1 O14842 1/20 0.48
FFAR4 Q5NUL3 1/20 0.48
BACE1 P56817 2/20 0.45
SYK P43405 1/20 0.44
AURKB Q96GD4 1/20 0.44
INCENP Q9NQS7 1/20 0.44
PTPN1 P18031 1/20 0.44
HTR1A P08908 1/20 0.43
MAPT P10636 2/20 0.42
NPC1 O15118 1/20 0.42
TP53 P04637 1/20 0.42
TSHR P16473 1/20 0.42
RAB9A P51151 1/20 0.42

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
SCHEMBL7765101 0.86 ABL1 (0.51) ABL1ABCB1BCRHDAC4HDAC2
SCHEMBL9959026 0.84 ABL1 (0.46) ABL1ABCB1BCRHDAC4HDAC2
SCHEMBL13675365 0.83 ABL1 (0.56) ABL1ABCB1BCRHDAC4HDAC2
SCHEMBL1520607 0.83 ABL1 (0.56) ABL1ABCB1BCRHDAC4HDAC2
SCHEMBL28792762 0.81 ABL1 (0.55) ABL1ABCB1BCRHDAC4HDAC2
SCHEMBL10821571 0.81 ABL1 (0.55) ABL1ABCB1BCRHDAC4HDAC2
SCHEMBL3756401 0.81 DPP4 (0.62) ABL1ABCB1BCRHDAC4HDAC2
SCHEMBL5677687 0.81 TP53 (0.53) ABL1ABCB1BCRHDAC4HDAC2
Hydrochloric Acid SCHEMBL12490497 0.80 DPP4 (0.60) ABL1ABCB1BCRHDAC4HDAC2
SCHEMBL4375331 0.80 PPARA (0.53) ABL1ABCB1BCRHDAC4HDAC2

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-0885236-A1 OLIGONUCLEOTIDE ANALOGS Codon Pharmaceuticals, Inc. (US) 1998-12-23 EP disclosed
WO-1997027206-A1 OLIGONUCLEOTIDE ANALOGS CODON PHARMACEUTICALS, INC. (US) 1997-07-31 WO disclosed