SCHEMBL7443771

SCHEMBL7443771

O=C(CCN1CCCCC1)c1ccc(Cl)s1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.56
MEN1 O00255 3/20 0.56
ALDH1A1 P00352 8/20 0.54
MAPT P10636 2/20 0.54
HPGD P15428 2/20 0.54
GSK3B P49841 1/20 0.51
GFER P55789 1/20 0.51
CYP1A2 P05177 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
HSD17B10 Q99714 1/20 0.46
LMNA P02545 2/20 0.46
POLB P06746 1/20 0.46
HTT P42858 1/20 0.46
L3MBTL1 Q9Y468 2/20 0.45
TP53 P04637 1/20 0.45
TSHR P16473 1/20 0.45

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
SCHEMBL7432625 0.87 KMT2A (0.56) KMT2AMEN1ALDH1A1MAPTHPGD
SCHEMBL6847731 0.82 KMT2A (0.60) KMT2AMEN1ALDH1A1MAPTHPGD
SCHEMBL9036006 0.81 MAPT (0.51) KMT2AMEN1ALDH1A1MAPTHPGD
Hydrochloric Acid SCHEMBL5358583 0.81 KMT2A (0.53) KMT2AMEN1ALDH1A1MAPTLMNA
SCHEMBL15988636 0.78 GSK3B (0.73) KMT2AMEN1ALDH1A1MAPTHPGD
SCHEMBL982447 0.73 GSK3B (0.71) KMT2AMEN1ALDH1A1MAPTHPGD
SCHEMBL17033397 0.73 ALDH1A1 (0.72) KMT2AMEN1ALDH1A1MAPTHPGD
SCHEMBL20460413 0.72 HPGD (0.96) ALDH1A1MAPTHPGDLMNAPOLB
SCHEMBL12123615 0.72 ALDH1A1 (0.59) KMT2AMEN1ALDH1A1MAPTHPGD
Hydrochloric Acid SCHEMBL5954595 0.72 ALDH1A1 (0.71) KMT2AMEN1ALDH1A1MAPTHPGD

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
EP-0571685-A1 Aryloxyheteroarylpropylamines, their preparation and use NOVO NORDISK A/S (DK) 1993-12-01 EP disclosed