SCHEMBL6132822

SCHEMBL6132822

COCCCCCCCCCOc1ccc(C(=O)O)cc1

nearest known ligand 0.75

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.75
TSHR P16473 1/20 0.75
PLA2G4B P0C869 7/20 0.73
RARB P10826 4/20 0.69
HTT P42858 2/20 0.69
PLA2G4A P47712 1/20 0.65
POLB P06746 1/20 0.63
APEX1 P27695 1/20 0.63
TDP1 Q9NUW8 1/20 0.63
PKM P14618 1/20 0.62
GAA P10253 1/20 0.62
MAPK1 P28482 1/20 0.60
L3MBTL1 Q9Y468 1/20 0.59

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
SCHEMBL6132656 1.00 TP53 (0.75) TP53TSHRPLA2G4BRARBHTT
SCHEMBL18682480 1.00 TP53 (0.75) TP53TSHRPLA2G4BRARBHTT
SCHEMBL18682414 0.95 RARB (0.77) TP53TSHRPLA2G4BRARBHTT
SCHEMBL7332700 0.95 RARB (0.77) TP53TSHRPLA2G4BRARBHTT
SCHEMBL7329413 0.95 RARB (0.77) TP53TSHRPLA2G4BRARBHTT
SCHEMBL7340390 0.95 RARB (0.77) TP53TSHRPLA2G4BRARBHTT
SCHEMBL2882011 0.95 PLA2G4B (0.70) TP53TSHRPLA2G4BRARBHTT
SCHEMBL8747416 0.93 RARB (0.74) TP53TSHRPLA2G4BRARBHTT
SCHEMBL209561 0.91 TP53 (0.82) TP53TSHRPLA2G4BRARBHTT
SCHEMBL14097198 0.91 TP53 (0.82) TP53TSHRPLA2G4BRARBHTT

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 3 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
WO-2000064927-A1 CYCLIC HEXAPEPTIDES HAVING ANTIBIOTIC ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-11-02 WO disclosed