SCHEMBL7003871

SCHEMBL7003871

Cc1sc(N(C)C(=O)Cc2c[nH]c3ccccc23)c(C(N)=O)c1C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.48
PKM P14618 2/20 0.48
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
MAPK8 P45983 2/20 0.43
MAPT P10636 6/20 0.43
ALDH1A1 P00352 4/20 0.43
KDM4E B2RXH2 4/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
HPGD P15428 1/20 0.43
MC4R P32245 2/20 0.43
MC5R P33032 2/20 0.43
MC3R P41968 2/20 0.43
HTT P42858 1/20 0.43
IDO1 P14902 1/20 0.42
LMNA P02545 2/20 0.42
SLC6A2 P23975 1/20 0.42
FNTA P49354 1/20 0.42
FNTB P49356 1/20 0.42
POLB P06746 2/20 0.41

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
SCHEMBL6999034 0.77 MAPK8 (0.68) PKMMEN1KMT2AMAPK8MAPT
SCHEMBL1852400 0.73 PKM (0.64) NPSR1PKMMEN1KMT2AMAPT
SCHEMBL29992703 0.73 PKM (0.64) NPSR1PKMMEN1KMT2AMAPT
SCHEMBL23198553 0.70 SMN1; SMN2 (0.51) NPSR1PKMMEN1KMT2AMAPT
SCHEMBL796067 0.69 PKM (0.62) NPSR1PKMMEN1KMT2AMAPT
SCHEMBL29756365 0.69 PKM (0.62) NPSR1PKMMEN1KMT2AMAPT
SCHEMBL1853982 0.69 GAA (0.61) NPSR1PKMMEN1KMT2AMAPT
SCHEMBL3262116 0.69 MAPT (0.68) NPSR1PKMMEN1KMT2AMAPK8
SCHEMBL29376364 0.69 MAPT (0.68) NPSR1PKMMEN1KMT2AMAPK8
SCHEMBL40822 0.69 MAPT (0.68) NPSR1PKMMEN1KMT2AMAPK8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1294707-A2 THIOPHENE DERIVATIVES ACTIVE AS KINASE INHIBITORS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM Pharmacia Italia S.p.A. (IT) 2003-03-26 EP claimed
WO-2001098290-A2 THIOPHENE DERIVATIVES ACTIVE AS KINASE INHIBITORS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM PHARMACIA ITALIA S.P.A. (IT) 2001-12-27 WO claimed