SCHEMBL8987873

SCHEMBL8987873

CCc1nccc(NC(=O)Cc2ccc(Oc3ncc(C(F)(F)F)cc3F)cc2)n1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.49
SMN1; SMN2 Q16637 3/20 0.47
RIOK2 Q9BVS4 2/20 0.44
KDR P35968 1/20 0.41
TEK Q02763 1/20 0.41
CSNK1D P48730 1/20 0.41
SCN9A Q15858 1/20 0.41
ALDH1A1 P00352 2/20 0.40
MAPK10 P53779 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
PDGFRB P09619 4/20 0.40
FLT3 P36888 3/20 0.40
FLT4 P35916 2/20 0.40
ROCK2 O75116 2/20 0.39
CSF1R P07333 2/20 0.39
PDGFRA P16234 1/20 0.39
BRAF P15056 1/20 0.39
GSK3B P49841 1/20 0.39
MAPK14 Q16539 1/20 0.39
KMT2A Q03164 1/20 0.38

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
SCHEMBL8988013 0.86 RIOK2 (0.48) SMN1; SMN2RIOK2KDRTEKCSNK1D
SCHEMBL8987866 0.81 ALDH1A1 (0.46) SMN1; SMN2RIOK2KDRALDH1A1MAPK10
SCHEMBL8987643 0.80 MAPK10 (0.46) LMNASMN1; SMN2RIOK2CSNK1DALDH1A1
SCHEMBL8987764 0.77 RIOK2 (0.51) SMN1; SMN2RIOK2KDRALDH1A1MAPK10
SCHEMBL8987881 0.77 SMN1; SMN2 (0.45) LMNASMN1; SMN2RIOK2CSNK1DALDH1A1
SCHEMBL8987685 0.77 EPHX2 (0.47) SMN1; SMN2RIOK2KDRTEKCSNK1D
SCHEMBL8987834 0.77 KMT2A (0.51) SMN1; SMN2RIOK2CSNK1DALDH1A1MAPK10
SCHEMBL8987904 0.76 CSNK1D (0.47) LMNASMN1; SMN2RIOK2KDRTEK
SCHEMBL8987813 0.76 ALDH1A1 (0.49) LMNASMN1; SMN2RIOK2ALDH1A1MAPK10
SCHEMBL8987880 0.76 SCN9A (0.43) LMNASMN1; SMN2SCN9AALDH1A1CSF1R

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