SCHEMBL3973967

SCHEMBL3973967

O=C(Nc1ccc(Cl)c(C(F)(F)F)c1)c1ccc(O)cc1

nearest known ligand 0.72

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDR P35968 1/20 0.66
TRPV1 Q8NER1 5/20 0.62
TMPRSS4 Q9NRS4 1/20 0.62
MAPT P10636 6/20 0.62
LMNA P02545 3/20 0.62
GAA P10253 2/20 0.62
RAB9A P51151 2/20 0.60
GRM4 Q14833 1/20 0.60
PDK1 Q15118 1/20 0.59
NPSR1 Q6W5P4 3/20 0.59
MEN1 O00255 3/20 0.59
KMT2A Q03164 3/20 0.59
HTT P42858 2/20 0.59
XBP1 P17861 1/20 0.57
NPC1 O15118 1/20 0.54
TP53 P04637 1/20 0.54
PTGDR2 Q9Y5Y4 1/20 0.53

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
SCHEMBL11793308 0.90 KDR (0.68) KDRTMPRSS4MAPTLMNAGAA
SCHEMBL3977997 0.87 KDR (0.64) KDRTRPV1TMPRSS4MAPTLMNA
SCHEMBL6055167 0.87 LMNA (0.70) KDRTRPV1TMPRSS4MAPTLMNA
SCHEMBL281864 0.85 KDR (0.85) KDRTRPV1PDK1
SCHEMBL28389908 0.85 KDR (0.61) KDRTRPV1TMPRSS4MAPTLMNA
SCHEMBL5631971 0.85 LMNA (0.70) KDRTRPV1TMPRSS4MAPTLMNA
SCHEMBL4249329 0.84 RAB9A (0.71) KDRTMPRSS4MAPTLMNAGAA
SCHEMBL10184841 0.84 KDR (0.59) KDRTRPV1TMPRSS4MAPTLMNA
SCHEMBL6365067 0.83 MAPT (0.64) KDRTRPV1MAPTLMNAGAA
SCHEMBL10656168 0.82 KDR (0.61) KDRTRPV1TMPRSS4MAPTLMNA

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
WO-2009054004-A2 PROCESS FOR THE PREPARATION OF SORAFENIB NATCO PHARMA LIMITED (IN) 2009-04-30 WO disclosed