SCHEMBL9763783

SCHEMBL9763783

CCCCCCCCCCCCOC(=O)CCSc1ccc(OC)cc1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.52
ALDH1A1 P00352 2/20 0.48
PLA2G4B P0C869 3/20 0.48
MTNR1A P48039 1/20 0.48
MTNR1B P49286 1/20 0.48
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
LMNA P02545 1/20 0.45
NAAA Q02083 1/20 0.45
DGKA P23743 1/20 0.45
TP53 P04637 1/20 0.44
TSHR P16473 1/20 0.44
HTR2C P28335 1/20 0.44
CYSLTR2 Q9NS75 1/20 0.44
CYSLTR1 Q9Y271 1/20 0.44

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
SCHEMBL13412642 0.93 ALDH1A1 (0.50) ATMALDH1A1PLA2G4BMTNR1AMTNR1B
SCHEMBL9764276 0.85 ALDH1A1 (0.53) ATMALDH1A1PLA2G4BNPC1RAB9A
SCHEMBL6928975 0.84 ATM (0.57) ATMALDH1A1MTNR1AMTNR1BNPC1
SCHEMBL14566051 0.83 DGKA (0.59) PLA2G4BDGKATP53TSHR
SCHEMBL17264205 0.81 ALDH1A1 (0.53) ALDH1A1PLA2G4BMTNR1AMTNR1BNPC1
SCHEMBL7516291 0.80 ALDH1A1 (0.49) ATMALDH1A1MTNR1AMTNR1BNPC1
SCHEMBL31329309 0.80 DGKA (0.54) NAAADGKA
SCHEMBL7073415 0.79 MTNR1A (0.62) ATMALDH1A1MTNR1AMTNR1BNPC1
SCHEMBL7260314 0.79 PTGES (0.55) ALDH1A1MTNR1AMTNR1BNPC1RAB9A
SCHEMBL5315774 0.79 PTGES (0.55) ALDH1A1MTNR1AMTNR1BNPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0246190-B1 DERIVATIVES OF ISOCYANURIC ACID CIBA-GEIGY AG (CH) 1991-12-04 EP disclosed
US-4863982-A HEAT, LIGHT AND OXIDATION STABILIZERS CIBA-GEIGY CORPORATION (US) 1989-09-05 US disclosed
EP-0246190-A2 Derivatives of isocyanuric acid CIBA-GEIGY AG (CH) 1987-11-19 EP disclosed
US-4699939-A OXIDATION RESISTANCE, PHOTOSTABILITY CIBA-GEIGY CORPORATION (US) 1987-10-13 US disclosed
EP-0219459-A2 Substituted p-hydroxyphenyl compounds CIBA-GEIGY AG (CH) 1987-04-22 EP disclosed