SCHEMBL7654466

SCHEMBL7654466

Cc1cccc(Cl)c1N1CCCN(CC(C)C)C1=S

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 8/20 0.38
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
PIK3CD O00329 1/20 0.33
ALDH1A1 P00352 2/20 0.32
TRPA1 O75762 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
DRD2 P14416 2/20 0.31
DRD3 P35462 2/20 0.31

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
SCHEMBL7653392 0.86 P2RX7 (0.39) P2RX7MEN1KMT2AALDH1A1L3MBTL1
SCHEMBL7653034 0.82 P2RX7 (0.36) P2RX7MEN1KMT2AL3MBTL1
SCHEMBL7650716 0.81 P2RX7 (0.34) P2RX7MEN1KMT2AALDH1A1L3MBTL1
SCHEMBL7656238 0.79 P2RX7 (0.36) P2RX7MEN1KMT2AALDH1A1L3MBTL1
SCHEMBL7651466 0.74 LMNA (0.38) P2RX7MEN1KMT2APIK3CDALDH1A1
SCHEMBL7652049 0.74 HTR2C (0.39) P2RX7KMT2AL3MBTL1
SCHEMBL8127545 0.71 P2RX7 (0.38) P2RX7ALDH1A1TRPA1DRD2DRD3
SCHEMBL8526757 0.62 MEN1 (0.50) P2RX7MEN1KMT2AALDH1A1L3MBTL1
SCHEMBL8665062 0.61 MEN1 (0.62) P2RX7MEN1KMT2A
SCHEMBL11170525 0.60 GAA (0.40) P2RX7MEN1KMT2AALDH1A1L3MBTL1

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 4 patents. 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 claimed
WO-1999011630-A1 SUBSTITUTED TETRAHYDRO-PYRIMIDINE-2(1H)-THIONE HDL-C ELEVATORS USEFUL AS ANTIATHEROSCLEROTIC AGENTS AMERICAN HOME PRODUCTS CORPORATION (US) 1999-03-11 WO claimed
US-6340687-B1 ELEVATE HIGH DENSITY LIPOPROTEIN CHOLESTEROL CONCENTRATION AMERICAN HOME PRODUCTS CORPORATION 2002-01-22 US disclosed
WO-1999011630-A1 SUBSTITUTED TETRAHYDRO-PYRIMIDINE-2(1H)-THIONE HDL-C ELEVATORS USEFUL AS ANTIATHEROSCLEROTIC AGENTS AMERICAN HOME PRODUCTS CORPORATION (US) 1999-03-11 WO disclosed