SCHEMBL8150263

SCHEMBL8150263

COc1ccc(C(CCC(Oc2ccccc2)C(=O)O)c2ccccc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 11/20 0.61
PPARA Q07869 11/20 0.61
CNR1 P21554 1/20 0.54
CNR2 P34972 1/20 0.54
CASR P41180 2/20 0.50
ACP3 P15309 1/20 0.48
MTNR1A P48039 2/20 0.47
MTNR1B P49286 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
SLC6A9 P48067 1/20 0.45
MEN1 O00255 1/20 0.45
LMNA P02545 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C9 P11712 1/20 0.45
CRHBP P24387 1/20 0.45
CYP2C19 P33261 1/20 0.45
HTT P42858 1/20 0.45
KMT2A Q03164 1/20 0.45

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
SCHEMBL7874488 0.80 PPARG (0.61) PPARGPPARACNR1CNR2ACP3
SCHEMBL13923928 0.79 PPARG (0.65) PPARGPPARA
SCHEMBL9423408 0.77 CNR2 (0.61) CNR1CNR2CASRACP3MTNR1A
SCHEMBL1564807 0.76 PPARA (0.59) PPARGPPARA
SCHEMBL9770359 0.76 PPARG (0.67) PPARGPPARAMTNR1AMTNR1BNPSR1
SCHEMBL14303460 0.75 PPARG (0.54) PPARGPPARACNR2ACP3L3MBTL1
SCHEMBL10419347 0.75 PPARG (0.67) PPARGPPARAL3MBTL1
SCHEMBL8935946 0.75 PPARG (0.73) PPARGPPARA
SCHEMBL5508320 0.75 PPARG (0.73) PPARGPPARA
SCHEMBL21991991 0.75 PPARG (0.66) PPARGPPARAMTNR1AMTNR1B

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-6121418-A PNA synthesis using a base-labile amino protecting group HOECHST AKTIENGESELLSCHAFT (DE) 2000-09-19 US disclosed