SCHEMBL8714673

SCHEMBL8714673

CCCCN1CC(=O)N(c2c(C)cccc2Cl)C1=S

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 11/20 0.57
KMT2A Q03164 11/20 0.57
GAA P10253 3/20 0.50
LMNA P02545 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
KDM4E B2RXH2 1/20 0.38
NPC1 O15118 1/20 0.38
ALDH1A1 P00352 1/20 0.38
ALOX15 P16050 1/20 0.38
RAB9A P51151 1/20 0.38
HCRTR1 O43613 1/20 0.38
HPGD P15428 1/20 0.37
CYP3A4 P08684 1/20 0.37
MAPT P10636 1/20 0.36
DRD3 P35462 1/20 0.36
RECQL P46063 1/20 0.36
P2RX7 Q99572 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
SCHEMBL8665062 0.87 MEN1 (0.62) MEN1KMT2AGAALMNASMN1; SMN2
SCHEMBL8664639 0.80 MEN1 (0.52) MEN1KMT2AGAAP2RX7
SCHEMBL9013933 0.79 KMT2A (0.53) MEN1KMT2AGAALMNASMN1; SMN2
SCHEMBL8526757 0.78 MEN1 (0.50) MEN1KMT2AGAAALDH1A1P2RX7
SCHEMBL8479289 0.77 KMT2A (0.70) MEN1KMT2AGAALMNASMN1; SMN2
SCHEMBL8711149 0.76 KMT2A (0.59) MEN1KMT2AGAALMNASMN1; SMN2
SCHEMBL8476134 0.73 KMT2A (0.75) MEN1KMT2AGAALMNASMN1; SMN2
SCHEMBL8915225 0.73 KMT2A (0.64) MEN1KMT2AGAALMNASMN1; SMN2
SCHEMBL7162444 0.72 MEN1 (0.43) MEN1KMT2AGAAP2RX7
SCHEMBL9013865 0.71 POLB (0.46) MEN1KMT2AGAAHCRTR1CYP3A4

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-5821372-A USEFUL FOR INCREASING BLOOD SERUM HIGH DENSITY LIPOPROTEIN LEVELS(HDL) AMERICAN HOME PRODUCTS CORPORATION (US) 1998-10-13 US disclosed