SCHEMBL7087892

SCHEMBL7087892

O=C(O)C(CO)COc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.50
PPARG P37231 1/20 0.49
PPARA Q07869 1/20 0.49
MTNR1A P48039 3/20 0.49
MTNR1B P49286 3/20 0.49
ALOX15 P16050 1/20 0.48
MME P08473 2/20 0.47
ALDH1A1 P00352 1/20 0.45
RECQL P46063 1/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
SCN4A P35499 2/20 0.44
CYP1A2 P05177 1/20 0.44
PKM P14618 1/20 0.43

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
SCHEMBL4849974 0.83 PPARG (0.51) LMNAPPARGPPARAMTNR1AMTNR1B
SCHEMBL11052073 0.83 LMNA (0.53) LMNAPPARGPPARAMTNR1AMTNR1B
SCHEMBL17205664 0.82 LMNA (0.44) LMNAPPARGPPARAMTNR1AMTNR1B
Ethane SCHEMBL5531789 0.82 LMNA (0.49) LMNAPPARGPPARAMTNR1AMTNR1B
SCHEMBL10983129 0.81 CYP1A2 (0.66) PPARGPPARAMMECYP1A2
SCHEMBL7862959 0.81 ALDH1A1 (0.52) PPARGPPARAMTNR1AMTNR1BALOX15
SCHEMBL11134968 0.80 CPA3 (0.57) LMNAPPARGPPARAMTNR1AMTNR1B
SCHEMBL5512521 0.79 LMNA (0.57) LMNAPPARGPPARAMTNR1AMTNR1B
SCHEMBL11115581 0.79 CYP2C19 (0.49) LMNAPPARGPPARAMTNR1AMTNR1B
SCHEMBL5514903 0.78 TBXA2R (0.47) LMNAPPARGPPARAMTNR1AMTNR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2003068806-A1 SOLID PHASE PEPTIDE SYNTHESIS ON SILICA JOHNSON MATTHEY PLC (GB) 2003-08-21 WO claimed
WO-2003068806-A1 SOLID PHASE PEPTIDE SYNTHESIS ON SILICA JOHNSON MATTHEY PLC (GB) 2003-08-21 WO disclosed