SCHEMBL8468149

SCHEMBL8468149

O=C(O)C(O)COc1ccccc1.O=C(O)C(O)COc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.59
ALOX15 P16050 1/20 0.52
MTNR1A P48039 3/20 0.51
MTNR1B P49286 3/20 0.51
PPARG P37231 1/20 0.51
PPARA Q07869 1/20 0.51
CYP2D6 P10635 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
ADRB2 P07550 1/20 0.47
ADRB1 P08588 1/20 0.47
ADRB3 P13945 1/20 0.47
SCN4A P35499 2/20 0.47
KDM4E B2RXH2 1/20 0.46
PTPRA P18433 1/20 0.46
PKM P14618 1/20 0.46

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
SCHEMBL5421055 1.00 LMNA (0.59) LMNAALOX15MTNR1AMTNR1BPPARG
SCHEMBL9283760 1.00 LMNA (0.59) LMNAALOX15MTNR1AMTNR1BPPARG
SCHEMBL2731803 1.00 LMNA (0.59) LMNAALOX15MTNR1AMTNR1BPPARG
SCHEMBL7047542 0.89 MAPT (0.51) PPARGPPARAPKM
SCHEMBL19132177 0.84 TP53 (0.56) LMNAALOX15PPARGPPARACYP2D6
SCHEMBL5512521 0.83 LMNA (0.57) LMNAALOX15MTNR1AMTNR1BPPARG
SCHEMBL23827366 0.82 TDP1 (0.44) LMNAPPARGPPARAL3MBTL1ADRB2
SCHEMBL18990146 0.82 LDHA (0.52) LMNAKDM4E
SCHEMBL23827362 0.82 TDP1 (0.44) LMNAPPARGPPARAL3MBTL1ADRB2
SCHEMBL11451793 0.82 NR4A2 (0.47) LMNAPPARGPPARAKDM4E

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-5886209-A CATALYTIC ESTERIFICATION OF THE CHIRALIC CARBOXYLIC ACID IN PRESENCE OF A DISTILLABLE ACID CATALYST WITH AN ALCOHOL, WITHOUT PURIFICATION OF THE BOTTOMS PRODUCT, REPEATING THE ESTERIFICATION STEP BASF AKTIENGESELLSCHAFT (DE) 1999-03-23 US disclosed