SCHEMBL7889806

SCHEMBL7889806

CN(C)c1ccc(C(=O)N2CCc3sccc3C2c2ccncc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LHCGR P22888 7/20 0.53
HHAT Q5VTY9 2/20 0.51
POLB P06746 1/20 0.45
MAPK1 P28482 2/20 0.45
NPSR1 Q6W5P4 1/20 0.45
TP53 P04637 1/20 0.43

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
SCHEMBL8170392 0.94 LHCGR (0.48) LHCGRHHATPOLBMAPK1NPSR1
SCHEMBL7885708 0.92 HHAT (0.56) LHCGRHHATPOLBMAPK1NPSR1
SCHEMBL7891831 0.89 HHAT (0.65) LHCGRHHATMAPK1NPSR1TP53
SCHEMBL7889885 0.88 POLB (0.61) LHCGRHHATPOLBMAPK1NPSR1
SCHEMBL8171464 0.87 HHAT (0.51) LHCGRHHATPOLBMAPK1NPSR1
SCHEMBL8171470 0.87 HHAT (0.51) LHCGRHHATPOLBMAPK1NPSR1
SCHEMBL7892023 0.87 MAPK1 (0.61) LHCGRHHATMAPK1NPSR1
SCHEMBL7888305 0.87 LHCGR (0.55) LHCGRHHATPOLBMAPK1NPSR1
SCHEMBL7880311 0.86 POLB (0.61) LHCGRHHATPOLBMAPK1
SCHEMBL7891997 0.86 LHCGR (0.56) LHCGRHHATMAPK1NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6177443-B1 ANTIDIABETIC AGENTS NOVO NORDISK A/S (DK) 2001-01-23 US disclosed
EP-0973778-A1 4,5,6,7-TETRAHYDRO-THIENO 3,2-c]PYRIDINE DERIVATIVES, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 2000-01-26 EP disclosed
WO-1998040385-A1 4,5,6,7-TETRAHYDRO-THIENO[3,2-c]PYRIDINE DERIVATIVES, THEIR PREPARATION AND USE NOVO NORDISK A/S (DK) 1998-09-17 WO disclosed