SCHEMBL8987662

SCHEMBL8987662

CC(=O)N(c1ccc(Oc2ccc(C(F)(F)F)cc2)cc1)c1ccnc(C(C)C)n1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 4/20 0.38
MMP9 P14780 4/20 0.38
SCN9A Q15858 6/20 0.38
FPR2 P25090 2/20 0.38
BRAF P15056 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
KCNH2 Q12809 1/20 0.36
LIPE Q05469 3/20 0.36
MAPK14 Q16539 2/20 0.35
CSF1R P07333 1/20 0.35
RAF1 P04049 1/20 0.35

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
SCHEMBL8987843 0.88 MAPK14 (0.41) SCN9AFPR2MAPK14
SCHEMBL8987783 0.86 CYP17A1 (0.37) MEN1KMT2AKCNH2MAPK14
SCHEMBL8987790 0.85 LIPE (0.40) MMP2MMP9SCN9AFPR2BRAF
SCHEMBL8987860 0.83 SCN9A (0.38) MMP2MMP9SCN9ABRAFMEN1
SCHEMBL8988022 0.83 MMP2 (0.38) MMP2MMP9SCN9ABRAFMEN1
SCHEMBL8987909 0.81 MAOB (0.37) MMP2MMP9SCN9ABRAFMEN1
SCHEMBL8987993 0.81 SCN9A (0.37) MMP2MMP9SCN9ABRAFKCNH2
SCHEMBL8987708 0.80 CSF1R (0.41) MMP2MMP9SCN9ABRAFMEN1
SCHEMBL8987689 0.79 MMP2 (0.38) MMP2MMP9SCN9ABRAFMEN1
SCHEMBL8987785 0.79 PROKR1 (0.38) MMP2MMP9SCN9ABRAFKCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5556859-A N-(4-pyrimidinyl)amide pesticides DOWELANCO (US) 1996-09-17 US disclosed