SCHEMBL7039779

SCHEMBL7039779

CS(=O)(=O)c1cc(N2CCCC2)c2ccc(COc3ccncc3)cc2n1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 1/20 0.36
METTL3 Q86U44 3/20 0.36
CSF1R P07333 1/20 0.36
F10 P00742 2/20 0.35
CYP3A4 P08684 1/20 0.35
PRKDC P78527 1/20 0.35
MMP1 P03956 2/20 0.33
CA12 O43570 2/20 0.33
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
CA4 P22748 2/20 0.33
MAOB P27338 2/20 0.33
CA5A P35218 2/20 0.33
CA7 P43166 2/20 0.33
CA5B Q9Y2D0 2/20 0.33
ADAM17 P78536 1/20 0.33
NCF1 P14598 1/20 0.33
PKM P14618 1/20 0.33
ALOX15 P16050 1/20 0.33
CASP1 P29466 1/20 0.33

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
SCHEMBL5524115 0.84 NCF1 (0.50) FGFR1CSF1RPRKDCADAM17NCF1
SCHEMBL5513306 0.74 NCF1 (0.61) ADAM17NCF1PKMHSD17B10METAP1
SCHEMBL5518639 0.74 NCF1 (0.51) PRKDCMAOBNCF1HSD17B10ALDH1A1
SCHEMBL5037370 0.73 NCF1 (0.50) FGFR1METTL3CSF1RPRKDCNCF1
SCHEMBL5521248 0.73 NCF1 (0.50) NCF1ALDH1A1
SCHEMBL5035781 0.72 NCF1 (0.52) FGFR1METTL3CSF1RCYP3A4PRKDC
Hydrochloric Acid SCHEMBL5040516 0.72 NCF1 (0.49) FGFR1METTL3CSF1RPRKDCNCF1
SCHEMBL5514274 0.72 NCF1 (0.49) NCF1
SCHEMBL5514944 0.72 NCF1 (0.46) MAOBNCF1
Hydrochloric Acid SCHEMBL5042681 0.72 NCF1 (0.51) FGFR1METTL3CSF1RCYP3A4PRKDC

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-1432421-A1 QUINOLINE DERIVATIVES AS NEUROPEPTIDE Y ANTAGONISTS F. Hoffmann-La Roche AG (CH) 2004-06-30 EP disclosed
WO-2003028726-A1 QUINOLINE DERIVATIVES AS NEUROPEPTIDE Y ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2003-04-10 WO disclosed