SCHEMBL6132617

SCHEMBL6132617

COCCCCCCCOc1ccc(C(=O)OC)cc1

nearest known ligand 0.77

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.77
RAB9A P51151 3/20 0.68
GAA P10253 1/20 0.61
L3MBTL1 Q9Y468 2/20 0.58
TDP1 Q9NUW8 1/20 0.57
CA1 P00915 1/20 0.56
CA2 P00918 1/20 0.56
TP53 P04637 1/20 0.54
TSHR P16473 1/20 0.54
NPC1 O15118 2/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
PLA2G4B P0C869 1/20 0.53
KDM4E B2RXH2 2/20 0.52
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
ALDH1A1 P00352 1/20 0.52
HTT P42858 1/20 0.52

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
SCHEMBL6132720 1.00 MAPT (0.77) MAPTRAB9AGAAL3MBTL1TDP1
SCHEMBL10295289 1.00 MAPT (0.77) MAPTRAB9AGAAL3MBTL1TDP1
SCHEMBL7324122 1.00 MAPT (0.77) MAPTRAB9AGAAL3MBTL1TDP1
SCHEMBL15693338 0.98 MAPT (0.79) MAPTRAB9AGAAL3MBTL1TDP1
SCHEMBL14926518 0.95 MAPT (0.70) MAPTRAB9AGAAL3MBTL1TDP1
SCHEMBL1796892 0.95 MAPT (0.79) MAPTRAB9AGAAL3MBTL1TDP1
SCHEMBL5054312 0.95 MAPT (0.85) MAPTRAB9AGAAL3MBTL1TDP1
SCHEMBL7325780 0.94 MAPT (0.68) MAPTRAB9AGAAL3MBTL1TDP1
SCHEMBL7336081 0.94 MAPT (0.68) MAPTRAB9AGAAL3MBTL1TDP1
SCHEMBL7324912 0.94 MAPT (0.68) MAPTRAB9AGAAL3MBTL1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6884868-B1 Cyclic hexapeptides having antibiotic activity FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2005-04-26 US disclosed
EP-1173472-A1 CYCLIC HEXAPEPTIDES HAVING ANTIBIOTIC ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-01-23 EP disclosed
US-6232290-B1 FUNGICIDES AGAINST PNEUMOCYSTIS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-05-15 US disclosed
EP-1053247-A1 ANTIFUNGAL CYCLOHEXAPEPTIDES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-11-22 EP disclosed
WO-2000064927-A1 CYCLIC HEXAPEPTIDES HAVING ANTIBIOTIC ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-11-02 WO disclosed
WO-1999040108-A1 NEW COMPOUND FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-08-12 WO disclosed