SCHEMBL7652778

SCHEMBL7652778

Cc1cc(Cl)ccc1N1CCCN(C(C)C)C1=S

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.40
HTT P42858 3/20 0.40
MAPT P10636 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
ALOX12 P18054 1/20 0.40
AKR1C3 P42330 1/20 0.38
P2RX7 Q99572 1/20 0.36
GAA P10253 2/20 0.35
MAPK1 P28482 1/20 0.35
ALDH1A1 P00352 4/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
KDM4E B2RXH2 1/20 0.34
POLB P06746 1/20 0.33
PDE4B Q07343 1/20 0.33
PDE4D Q08499 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
CRHR1 P34998 1/20 0.33

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
SCHEMBL7655761 0.89 ALDH1A1 (0.42) LMNAHTTMAPTSMN1; SMN2NPSR1
SCHEMBL7652026 0.81 AKR1C3 (0.40) LMNAHTTMAPTSMN1; SMN2NPSR1
SCHEMBL7651466 0.81 LMNA (0.38) LMNAHTTMAPTSMN1; SMN2NPSR1
SCHEMBL7648847 0.81 LMNA (0.38) LMNAHTTMAPTSMN1; SMN2NPSR1
SCHEMBL8117993 0.80 POLB (0.35) LMNAHTTMAPTSMN1; SMN2NPSR1
SCHEMBL7653896 0.76 LMNA (0.35) LMNAHTTMAPTSMN1; SMN2NPSR1
SCHEMBL7650716 0.72 P2RX7 (0.34) SMN1; SMN2P2RX7ALDH1A1MEN1KMT2A
SCHEMBL7653481 0.71 ALDH1A1 (0.38) LMNAHTTMAPTAKR1C3GAA
SCHEMBL7652054 0.70 MEN1 (0.40) LMNAHTTMAPTSMN1; SMN2NPSR1
SCHEMBL7649121 0.70 ALDH1A1 (0.45) LMNAHTTMAPTNPSR1ALDH1A1

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