SCHEMBL3225952

SCHEMBL3225952

[NH]C(=O)Cc1ccc(Nc2cc(Cl)cc(Cl)c2)cc1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.40
NR1H4 Q96RI1 1/20 0.40
ALDH1A1 P00352 1/20 0.40
GAA P10253 1/20 0.40
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
LMNA P02545 2/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
P2RY1 P47900 1/20 0.39
CNR1 P21554 1/20 0.38
RAB9A P51151 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
NLRP3 Q96P20 1/20 0.37
KDM4E B2RXH2 1/20 0.37
POLB P06746 1/20 0.36

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
SCHEMBL13802505 0.85 NR1H4 (0.53) NR1H4ALDH1A1GAAMEN1KMT2A
SCHEMBL3225959 0.83 CA2 (0.47) HTTCNR1NPSR1KDM4E
SCHEMBL1579077 0.77 SHMT1 (0.47) MAPTNR1H4ALDH1A1MEN1KMT2A
SCHEMBL3644216 0.76 LMNA (0.55) MAPTALDH1A1MEN1KMT2ALMNA
SCHEMBL5465427 0.72 PDE4B (0.53) ALDH1A1GAAMEN1KMT2ALMNA
SCHEMBL9851152 0.70 ALDH1A1 (0.46) MAPTALDH1A1GAAMEN1KMT2A
SCHEMBL1686395 0.68 TSHR (0.57) MAPTALDH1A1GAAMEN1KMT2A
Acetic Acid SCHEMBL1446325 0.68 MAPT (0.59) MAPTALDH1A1GAAMEN1KMT2A
SCHEMBL31324192 0.68 MAPT (0.50) MAPTALDH1A1MEN1KMT2ALMNA
SCHEMBL31324190 0.68 MAPT (0.63) MAPTALDH1A1MEN1KMT2ACNR1

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-2010010380-A1 POTASSIUM ION CHANNEL MODULATORS & USES THEREOF LECTUS THERAPEUTICS LIMITED (GB) 2010-01-28 WO disclosed