SCHEMBL14744261

SCHEMBL14744261

CCS(=O)(=O)c1ccc(CC(=O)Oc2c(F)c(F)c(F)c(F)c2F)cc1

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PSIP1 O75475 1/20 0.45
RORC P51449 14/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
SENP1 Q9P0U3 1/20 0.40
MMP9 P14780 1/20 0.40

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
SCHEMBL31226055 0.80 KMT2A (0.55) SMN1; SMN2SENP1
SCHEMBL257153 0.79 MMP9 (0.57) PSIP1RORCSMN1; SMN2MMP9
SCHEMBL9059841 0.79 SMN1; SMN2 (0.47) SMN1; SMN2SENP1
SCHEMBL31226071 0.79 SENP1 (0.61) SMN1; SMN2SENP1
SCHEMBL2665972 0.78 KMT2A (0.57) PSIP1RORCSMN1; SMN2
SCHEMBL31225821 0.78 KMT2A (0.52) SMN1; SMN2SENP1
SCHEMBL6937307 0.77 SMN1; SMN2 (0.67) SMN1; SMN2SENP1
SCHEMBL5716133 0.77 HPGD (0.54) SMN1; SMN2
SCHEMBL31225539 0.76 KMT2A (0.51) SMN1; SMN2SENP1
SCHEMBL5715921 0.75 SMN1; SMN2 (0.50) SMN1; SMN2SENP1

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-2013029338-A1 NOVEL COMPOUNDS GLAXO GROUP LIMITED (GB) 2013-03-07 WO disclosed