SCHEMBL7146306

SCHEMBL7146306

Cc1cc(N2CCCC2)c2ccc(-c3ccc(CC=O)cc3)cc2n1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NCF1 P14598 6/20 0.53
ADRB2 P07550 1/20 0.42
ADRB1 P08588 1/20 0.42
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
HTT P42858 4/20 0.40
MAPK1 P28482 3/20 0.40
LMNA P02545 3/20 0.40
HSD17B10 Q99714 2/20 0.40
USP2 O75604 2/20 0.40
PKM P14618 1/20 0.40
NPY5R Q15761 1/20 0.40
SMN1; SMN2 Q16637 4/20 0.38
KDM4E B2RXH2 2/20 0.38
MAPT P10636 2/20 0.38
RECQL P46063 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
EGLN1 Q9GZT9 2/20 0.38
NPSR1 Q6W5P4 2/20 0.37
TSHR P16473 1/20 0.37

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
SCHEMBL7137892 0.99 NCF1 (0.55) NCF1ADRB2ADRB1MEN1KMT2A
SCHEMBL7146671 0.90 NCF1 (0.57) NCF1ADRB2ADRB1MEN1KMT2A
SCHEMBL5405742 0.88 NCF1 (0.56) NCF1ADRB2ADRB1MEN1KMT2A
SCHEMBL7140923 0.83 NCF1 (0.46) NCF1ADRB2ADRB1MEN1KMT2A
SCHEMBL5397410 0.83 NCF1 (0.72) NCF1ADRB2ADRB1MEN1KMT2A
SCHEMBL5401181 0.82 NCF1 (0.74) NCF1ADRB2ADRB1MEN1KMT2A
SCHEMBL5407150 0.81 NCF1 (0.54) NCF1ADRB2ADRB1MEN1KMT2A
SCHEMBL27574131 0.81 NCF1 (0.52) NCF1ADRB2ADRB1MEN1KMT2A
SCHEMBL5406740 0.81 NCF1 (0.53) NCF1ADRB2ADRB1MEN1KMT2A
SCHEMBL5405102 0.80 NCF1 (0.56) NCF1MEN1KMT2AHSD17B10PKM

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
EP-1318981-A2 QUINOLINE AND QUINAZOLINE DERIVATIVES AS LIGANDS FOR THE NEUROPEPTIDE Y RECEPTOR F. HOFFMANN-LA ROCHE AG (CH) 2003-06-18 EP claimed
WO-2002020488-A2 QUINOLINE AND QUINAZOLINE DERIVATIVES AS LIGANDS FOR THE NEUROPEPTIDE Y RECEPTOR F. HOFFMANN-LA ROCHE AG (CH) 2002-03-14 WO claimed
EP-1318981-A2 QUINOLINE AND QUINAZOLINE DERIVATIVES AS LIGANDS FOR THE NEUROPEPTIDE Y RECEPTOR F. HOFFMANN-LA ROCHE AG (CH) 2003-06-18 EP disclosed
WO-2002020488-A2 QUINOLINE AND QUINAZOLINE DERIVATIVES AS LIGANDS FOR THE NEUROPEPTIDE Y RECEPTOR F. HOFFMANN-LA ROCHE AG (CH) 2002-03-14 WO disclosed