SCHEMBL7653896

SCHEMBL7653896

C=CCN1CCCN(c2ccc(Cl)cc2C)C1=S

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.35
HTT P42858 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
GAA P10253 1/20 0.35
MAPK1 P28482 1/20 0.35
AKR1C3 P42330 1/20 0.35
MAPT P10636 1/20 0.34
ALOX12 P18054 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
HPGD P15428 2/20 0.34
APOBEC3G Q9HC16 2/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
PPARG P37231 1/20 0.34
NCOA2 Q15596 1/20 0.34
NCOA1 Q15788 1/20 0.34
GRM5 P41594 1/20 0.34
PDE4B Q07343 1/20 0.33
PDE4D Q08499 1/20 0.33
P2RX7 Q99572 2/20 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
SCHEMBL7653880 0.90 MEN1 (0.39) LMNAHTTSMN1; SMN2MAPTNPSR1
SCHEMBL7648847 0.84 LMNA (0.38) LMNAHTTSMN1; SMN2GAAMAPK1
SCHEMBL7651466 0.82 LMNA (0.38) LMNAHTTSMN1; SMN2GAAMAPK1
SCHEMBL7652026 0.77 AKR1C3 (0.40) LMNAHTTSMN1; SMN2GAAMAPK1
SCHEMBL7652778 0.76 LMNA (0.40) LMNAHTTSMN1; SMN2GAAMAPK1
SCHEMBL7653034 0.75 P2RX7 (0.36) LMNAMAPTMEN1KMT2AP2RX7
SCHEMBL7650742 0.74 MEN1 (0.42) LMNAHTTSMN1; SMN2MAPTNPSR1
SCHEMBL7652054 0.72 MEN1 (0.40) LMNAHTTSMN1; SMN2MAPTALOX12
SCHEMBL7653481 0.70 ALDH1A1 (0.38) LMNAHTTGAAAKR1C3MAPT
SCHEMBL8134613 0.68 POLB (0.35) AKR1C3GRM5P2RX7ALDH1A1KDM4E

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