SCHEMBL7880311

SCHEMBL7880311

COc1ccc(C(=O)N2CCc3sccc3C2c2ccncc2)cc1

nearest known ligand 0.69

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.61
LHCGR P22888 11/20 0.59
HHAT Q5VTY9 1/20 0.52
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
CNR1 P21554 1/20 0.51
MAPK1 P28482 1/20 0.50

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
SCHEMBL7891790 0.93 POLB (0.69) POLBLHCGRHHATMEN1KMT2A
SCHEMBL7880265 0.90 HHAT (0.65) POLBLHCGRHHAT
SCHEMBL7891804 0.88 LHCGR (0.64) POLBLHCGRMEN1KMT2ACNR1
SCHEMBL7880463 0.88 LHCGR (0.73) POLBLHCGRMEN1KMT2AMAPK1
SCHEMBL7885853 0.88 LHCGR (0.73) POLBLHCGRMEN1KMT2AMAPK1
SCHEMBL7880417 0.88 POLB (0.63) POLBLHCGR
SCHEMBL7880530 0.88 POLB (0.63) POLBLHCGR
SCHEMBL7891997 0.87 LHCGR (0.56) LHCGRHHATMAPK1
SCHEMBL7880479 0.87 LHCGR (0.64) LHCGRHHATMAPK1
SCHEMBL7885913 0.87 LHCGR (0.56) POLBLHCGRHHATMAPK1

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