SCHEMBL10693803

SCHEMBL10693803

CCOC(=O)C(Cc1c(F)c(F)c(F)c(F)c1F)C(=O)OCC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP8 P22894 1/20 0.39
RAB9A P51151 2/20 0.38
GAA P10253 2/20 0.38
MTOR P42345 1/20 0.38
ALDH1A1 P00352 3/20 0.37
TSHR P16473 1/20 0.37
TDP1 Q9NUW8 2/20 0.37
KMT2A Q03164 2/20 0.37
MEN1 O00255 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
POLB P06746 1/20 0.35
HSD17B10 Q99714 2/20 0.34
LMNA P02545 1/20 0.34
NPC1 O15118 1/20 0.34
MITF O75030 1/20 0.34
TP53 P04637 1/20 0.34
RECQL P46063 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
ALOX15 P16050 1/20 0.33
PIN1 Q13526 1/20 0.33

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
SCHEMBL20002727 0.80 MMP8 (0.41) MMP8ALDH1A1TSHRTDP1KMT2A
SCHEMBL5736978 0.78 KMT2A (0.50) MMP8GAAALDH1A1TSHRTDP1
SCHEMBL8871746 0.74 MMP1 (0.37) ALDH1A1TDP1
SCHEMBL10925736 0.73 FOLH1 (0.37) KMT2A
SCHEMBL16218019 0.73 TDP1 (0.50) MMP8ALDH1A1TSHRTDP1KMT2A
SCHEMBL348676 0.72 CTSS (0.32) SMN1; SMN2
SCHEMBL3714554 0.72 KMT2A (0.45) MMP8GAAALDH1A1TSHRTDP1
SCHEMBL5737042 0.72 KMT2A (0.48) MMP8ALDH1A1TSHRTDP1KMT2A
SCHEMBL7436472 0.72 MMP8 (0.54) MMP8GAAALDH1A1TDP1KMT2A
SCHEMBL1312803 0.71 MMP8 (0.62) MMP8ALDH1A1TSHRTDP1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4738803-A ENZYME INHIBITORS ROQUES BERNARD (FR) 1988-04-19 US disclosed
US-4618708-A ENKEPHALINASE INHIBITOR, ANALGESICS, ANTIDEPRESSANT, ANTIDIARRHEA, OR HYPOTENSIVE AGENT ROQUES BERNARD (FR) 1986-10-21 US disclosed