SCHEMBL8308181

SCHEMBL8308181

COc1ccccc1CNC(=O)c1cc(=O)[nH]c2ccc(S(=O)(=O)N3CCCCC3C)cc12

nearest known ligand 0.83

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.83
MEN1 O00255 1/20 0.66
KMT2A Q03164 1/20 0.66
ALDH1A1 P00352 2/20 0.65
LMNA P02545 1/20 0.65
HTT P42858 1/20 0.65
RXFP1 Q9HBX9 1/20 0.65
POLB P06746 3/20 0.64
TDP1 Q9NUW8 2/20 0.64
TP53 P04637 3/20 0.63
BACE1 P56817 2/20 0.57
F2 P00734 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54

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
SCHEMBL8307106 0.92 MAPT (0.72) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL8308124 0.91 MAPT (1.00) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL8305904 0.91 MAPT (0.86) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL8307086 0.89 MAPT (0.71) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL8305817 0.88 ALDH1A1 (0.81) MAPTALDH1A1LMNAHTTRXFP1
SCHEMBL8307104 0.87 MAPT (0.72) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL8304392 0.85 ALDH1A1 (0.68) MAPTALDH1A1LMNAHTTRXFP1
SCHEMBL8306993 0.85 MAPT (0.70) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL8307022 0.84 MAPT (0.61) MAPTMEN1KMT2AALDH1A1LMNA
SCHEMBL8312671 0.84 MAPT (0.68) MAPTMEN1KMT2AALDH1A1LMNA

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-2004078731-A1 QUINOLINE-CARBOXYLIC ACIDS AND THE DERIVATIVES THEREOF, A FOCUSED LIBRARY 'CHEMICAL DIVERSITY RESEARCH INSTITUTE', LTD. (RU) 2004-09-16 WO disclosed