SCHEMBL9013774

SCHEMBL9013774

CCN1CC(=O)N(c2ccccc2Cl)C1=S

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 12/20 0.60
KMT2A Q03164 12/20 0.60
GAA P10253 2/20 0.60
HCRTR1 O43613 1/20 0.60
LMNA P02545 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
CYP3A4 P08684 1/20 0.44
MAPT P10636 1/20 0.44
MGLL Q99685 1/20 0.44
P2RX7 Q99572 1/20 0.40

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
SCHEMBL8475279 0.85 KMT2A (0.60) MEN1KMT2AGAAHCRTR1LMNA
SCHEMBL8475297 0.84 GAA (0.64) MEN1KMT2AGAAHCRTR1LMNA
SCHEMBL9013933 0.84 KMT2A (0.53) MEN1KMT2AGAAHCRTR1LMNA
SCHEMBL8660441 0.83 MEN1 (0.50) MEN1KMT2AGAAHCRTR1CYP3A4
SCHEMBL9013742 0.82 MEN1 (0.46) MEN1KMT2AGAAHCRTR1LMNA
SCHEMBL6031707 0.80 KMT2A (0.54) MEN1KMT2AGAAHCRTR1LMNA
SCHEMBL8475522 0.80 FAAH (0.49) MEN1KMT2AGAAHCRTR1LMNA
SCHEMBL8695358 0.80 GAA (0.45) MEN1KMT2AGAAHCRTR1LMNA
SCHEMBL8662135 0.79 GAA (0.44) MEN1KMT2AGAAHCRTR1LMNA
SCHEMBL8665062 0.79 MEN1 (0.62) MEN1KMT2AGAAHCRTR1LMNA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5554607-A INCREASING HDL CHOLESTEROL AMERICAN HOME PRODUCTS CORPORATION (US) 1996-09-10 US claimed
US-5554607-A INCREASING HDL CHOLESTEROL AMERICAN HOME PRODUCTS CORPORATION (US) 1996-09-10 US disclosed