SCHEMBL328394

SCHEMBL328394

Fc1cc(I)cc(F)c1Oc1cccnc1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.53
TDP1 Q9NUW8 1/20 0.53
MAP2K1 Q02750 1/20 0.45
ALDH1A1 P00352 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
CYP19A1 P11511 3/20 0.42
HTT P42858 1/20 0.42
FFAR4 Q5NUL3 3/20 0.41
NPC1 O15118 1/20 0.40
GAA P10253 1/20 0.40
HPGD P15428 1/20 0.40
RAB9A P51151 1/20 0.40
CYP11B1 P15538 1/20 0.40
CYP11B2 P19099 1/20 0.40
PPARD Q03181 1/20 0.38
LTA4H P09960 1/20 0.38
FEN1 P39748 1/20 0.38
TDO2 P48775 1/20 0.37
MAP4K4 O95819 1/20 0.37

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
SCHEMBL779090 0.83 LMNA (0.53) LMNATDP1ALDH1A1SMN1; SMN2CYP19A1
SCHEMBL6863054 0.81 MAP2K1 (0.54) LMNATDP1MAP2K1ALDH1A1SMN1; SMN2
SCHEMBL11990105 0.80 LMNA (0.49) LMNATDP1ALDH1A1SMN1; SMN2CYP19A1
SCHEMBL11989288 0.80 LMNA (0.49) LMNATDP1ALDH1A1SMN1; SMN2CYP19A1
SCHEMBL14997983 0.80 LMNA (0.49) LMNATDP1ALDH1A1SMN1; SMN2CYP19A1
SCHEMBL15597016 0.78 LTA4H (0.44) TDP1MAP2K1LTA4H
SCHEMBL13604562 0.75 LMNA (0.44) LMNATDP1ALDH1A1SMN1; SMN2FFAR4
SCHEMBL14021948 0.74 LMNA (0.46) LMNATDP1ALDH1A1SMN1; SMN2CYP19A1
SCHEMBL30535283 0.73 LMNA (0.82) LMNATDP1ALDH1A1SMN1; SMN2CYP19A1
SCHEMBL676142 0.73 LMNA (0.82) LMNATDP1ALDH1A1SMN1; SMN2CYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2014028334-A1 SELECTIVE MMP INHIBITORS SYMPHONY EVOLUTION, INC. (US) 2014-02-20 WO disclosed
EP-1511488-B1 HUMAN ADAM-10 INHIBITORS SYMPHONY EVOLUTION INC (US) 2013-05-22 EP disclosed
EP-2436676-A1 Human adam-10 inhibitors Symphony Evolution, Inc. (US) 2012-04-04 EP disclosed
EP-2428509-A1 Human adam-10 inhibitors Symphony Evolution, Inc. (US) 2012-03-14 EP disclosed