SCHEMBL7652026

SCHEMBL7652026

Cc1cc(Cl)ccc1N1CCCN(C)C1=S

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 1/20 0.40
POLB P06746 2/20 0.39
LMNA P02545 3/20 0.37
HTT P42858 3/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
GAA P10253 2/20 0.37
MAPK1 P28482 1/20 0.37
MAPT P10636 2/20 0.36
ALOX12 P18054 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
ALDH1A1 P00352 5/20 0.36
KDM4E B2RXH2 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
PKM P14618 1/20 0.36
HSD17B10 Q99714 1/20 0.36
AVPR1A P37288 1/20 0.35
PDE4B Q07343 1/20 0.35
PDE4D Q08499 1/20 0.35
MAPK14 Q16539 1/20 0.35

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
SCHEMBL7649121 0.88 ALDH1A1 (0.45) LMNAHTTMAPTNPSR1ALDH1A1
SCHEMBL7652778 0.81 LMNA (0.40) AKR1C3POLBLMNAHTTSMN1; SMN2
SCHEMBL7648847 0.81 LMNA (0.38) AKR1C3POLBLMNAHTTSMN1; SMN2
SCHEMBL7651466 0.79 LMNA (0.38) AKR1C3LMNAHTTSMN1; SMN2GAA
SCHEMBL7653896 0.77 LMNA (0.35) AKR1C3LMNAHTTSMN1; SMN2GAA
SCHEMBL7653481 0.75 ALDH1A1 (0.38) AKR1C3POLBLMNAHTTGAA
SCHEMBL7656238 0.70 P2RX7 (0.36) LMNASMN1; SMN2GAAMAPTALOX12
SCHEMBL7655761 0.70 ALDH1A1 (0.42) LMNAHTTSMN1; SMN2MAPTALOX12
SCHEMBL7650742 0.70 MEN1 (0.42) LMNAHTTSMN1; SMN2MAPTNPSR1
SCHEMBL8117993 0.69 POLB (0.35) AKR1C3POLBLMNAHTTSMN1; SMN2

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