SCHEMBL1531707

SCHEMBL1531707

CCC(Nc1cc(Cl)cc(Cl)c1)C(N)=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.38
MAPT P10636 5/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
BTK Q06187 2/20 0.38
ALDH1A1 P00352 3/20 0.38
GAA P10253 2/20 0.38
LMNA P02545 2/20 0.37
ALOX12 P18054 1/20 0.37
GRM4 Q14833 2/20 0.36
ACP1 P24666 1/20 0.36
GRN P28799 1/20 0.36
SORT1 Q99523 1/20 0.36
PIP4K2A P48426 2/20 0.35
NPSR1 Q6W5P4 2/20 0.35
HPGD P15428 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
THRB P10828 1/20 0.35
RAB9A P51151 1/20 0.35
FABP4 P15090 1/20 0.35

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
SCHEMBL1531545 0.84 GRN (0.46) L3MBTL1MAPTMEN1KMT2AALDH1A1
SCHEMBL1531548 0.84 GRN (0.46) L3MBTL1MAPTMEN1KMT2AALDH1A1
SCHEMBL1532302 0.84 LMNA (0.48) MAPTMEN1KMT2AALDH1A1GAA
SCHEMBL8996235 0.77 HTT (0.38) L3MBTL1MAPTMEN1KMT2AALDH1A1
SCHEMBL8996290 0.77 HTT (0.38) L3MBTL1MAPTMEN1KMT2AALDH1A1
SCHEMBL11497907 0.76 ALDH1A1 (0.44) MAPTMEN1KMT2ABTKALDH1A1
SCHEMBL1531518 0.75 MEN1 (0.44) L3MBTL1MAPTMEN1KMT2AALDH1A1
SCHEMBL1531587 0.74 GRM4 (0.41) MAPTMEN1KMT2AGAAGRM4
SCHEMBL1531584 0.74 GRM4 (0.41) MAPTMEN1KMT2AGAAGRM4
SCHEMBL28009264 0.72 GAA (0.50) L3MBTL1MAPTMEN1KMT2AALDH1A1

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
WO-2011029043-A1 HETEROARYL BTK INHIBITORS BIOGEN IDEC MA INC. (US) 2011-03-10 WO disclosed