SCHEMBL7653377

SCHEMBL7653377

C=CCNCCCNc1ccc(Cl)cc1C

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.39
NOX1 Q9Y5S8 1/20 0.38
LMNA P02545 2/20 0.37
MAPT P10636 2/20 0.37
MAPK1 P28482 1/20 0.37
GAA P10253 2/20 0.36
ALDH1A1 P00352 2/20 0.36
POLB P06746 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C19 P33261 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
SCHEMBL7654451 0.89 KDM4E (0.43) KDM4EMEN1KMT2ANPSR1LMNA
SCHEMBL11242524 0.83 NOX1 (0.45) SMN1; SMN2NOX1LMNAMAPTMAPK1
SCHEMBL7650131 0.82 SMN1; SMN2 (0.46) KDM4EMEN1KMT2ASMN1; SMN2NOX1
SCHEMBL7654647 0.78 SMN1; SMN2 (0.40) KDM4EMEN1KMT2ASMN1; SMN2NOX1
SCHEMBL7655919 0.75 FERMT2 (0.52) SMN1; SMN2NOX1MAPTGAA
SCHEMBL7655772 0.75 SMN1; SMN2 (0.48) KDM4EMEN1KMT2ASMN1; SMN2NOX1
SCHEMBL7655830 0.75 SMN1; SMN2 (0.44) KDM4EMEN1KMT2ASMN1; SMN2NOX1
SCHEMBL7657018 0.75 NSD2 (0.44) KDM4EMEN1KMT2ASMN1; SMN2NOX1
Bromide SCHEMBL7657001 0.74 SMN1; SMN2 (0.43) KDM4EMEN1KMT2ASMN1; SMN2NOX1
SCHEMBL11864091 0.74 MAPK1 (0.44) KDM4EMEN1KMT2ANPSR1SMN1; SMN2

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
US-6340687-B1 ELEVATE HIGH DENSITY LIPOPROTEIN CHOLESTEROL CONCENTRATION AMERICAN HOME PRODUCTS CORPORATION 2002-01-22 US disclosed