SCHEMBL5315438

SCHEMBL5315438

Cc1ccccc1CN(CC1CCC(C(=O)NCc2ccc(C(=O)O)cc2)CC1)S(=O)(=O)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TAS2R14 Q9NYV8 14/20 0.56
MAPK1 P28482 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
PTGES O14684 2/20 0.51
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
LMNA P02545 1/20 0.45

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
SCHEMBL3851328 0.93 TAS2R14 (0.59) TAS2R14MAPK1SMN1; SMN2MEN1KMT2A
SCHEMBL13714165 0.93 TAS2R14 (0.59) TAS2R14MAPK1SMN1; SMN2MEN1KMT2A
SCHEMBL3856007 0.92 MAPK1 (0.52) TAS2R14MAPK1SMN1; SMN2MEN1KMT2A
SCHEMBL3852268 0.89 PTGES (0.61) TAS2R14PTGESMEN1KMT2ALMNA
SCHEMBL5311979 0.86 PTGES (0.69) TAS2R14PTGESMEN1KMT2ALMNA
SCHEMBL13714179 0.84 TAS2R14 (0.59) TAS2R14MEN1KMT2A
SCHEMBL3853015 0.83 TAS2R14 (0.72) TAS2R14MAPK1MEN1KMT2ALMNA
SCHEMBL3856384 0.82 TAS2R14 (0.56) TAS2R14MAPK1PTGESLMNA
SCHEMBL3858876 0.82 TAS2R14 (0.55) TAS2R14MEN1KMT2A
SCHEMBL3853063 0.81 TAS2R14 (0.76) TAS2R14MAPK1LMNA

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-2007067817-A1 ABCA1 ELEVATING COMPOUNDS CV THERAPEUTICS, INC. (US) 2007-06-14 WO disclosed