Sugi Predict

Sugi Predict / Compounds / SCHEMBL8910174

SCHEMBL8910174

SCHEMBL8910174

Cc1cc(C)c(-c2nc(-c3ccc(OCC(O)COCCCCCCCCCC(C)C)cc3O)nc(-c3ccc(OCC(O)COCCCCCCCCCC(C)C)cc3O)n2)c(C)c1

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ADRB2 P07550 4/20 0.34
▸ ADRB1 P08588 2/20 0.34
▸ PLA2G4B P0C869 1/20 0.33
▸ RARB P10826 1/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ SMN1; SMN2 Q16637 2/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ NPC1 O15118 1/20 0.30
▸ HTR1A P08908 1/20 0.30
▸ HTR1D P28221 1/20 0.30
▸ HTR1B P28222 1/20 0.30

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
SCHEMBL29356725 0.89 PLA2G4B (0.38) ADRB2ADRB1PLA2G4BKMT2ASMN1; SMN2
SCHEMBL769247 0.89 PLA2G4B (0.38) ADRB2ADRB1PLA2G4BKMT2ASMN1; SMN2
SCHEMBL8909196 0.89 RARB (0.40) ADRB2RARBKMT2AMEN1NPC1
SCHEMBL38700 0.82 PLA2G4B (0.44) PLA2G4BKMT2AMEN1NPC1
SCHEMBL7704728 0.82 PLA2G4B (0.44) PLA2G4BKMT2AMEN1NPC1
SCHEMBL29497660 0.82 PLA2G4B (0.44) PLA2G4BKMT2AMEN1NPC1
SCHEMBL7925990 0.82 PLA2G4B (0.44) PLA2G4BKMT2AMEN1NPC1
SCHEMBL7524555 0.82 PLA2G4B (0.44) PLA2G4BKMT2AMEN1NPC1
SCHEMBL18231906 0.82 PLA2G4B (0.44) PLA2G4BKMT2AMEN1NPC1
SCHEMBL31370 0.82 PLA2G4B (0.44) PLA2G4BKMT2AMEN1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5686233-A PHOTOGRAPHIC FILM STABILIZER CIBA-GEIGY CORPORATION (US) 1997-11-11 — — US disclosed