SCHEMBL10387140

SCHEMBL10387140

COC=C(C(=O)OC)c1ccccc1COC(=O)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.47
KMT2A Q03164 2/20 0.44
SLC6A3 Q01959 2/20 0.44
SLC6A2 P23975 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.43
TSHR P16473 1/20 0.41
MAPT P10636 3/20 0.41
RAB9A P51151 3/20 0.41
POLB P06746 1/20 0.41
PKM P14618 1/20 0.41
LMNA P02545 1/20 0.40
CASP3 P42574 1/20 0.40
SENP8 Q96LD8 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
SENP6 Q9GZR1 1/20 0.40
NPC1 O15118 1/20 0.39
MAPK1 P28482 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39

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
SCHEMBL10387139 1.00 PPARG (0.47) PPARGKMT2ASLC6A3SLC6A2TDP1
SCHEMBL10387141 0.90 PPARG (0.49) PPARGKMT2ASLC6A3SLC6A2TDP1
SCHEMBL10434828 0.87 TDP1 (0.51) KMT2ATDP1L3MBTL1TSHRLMNA
SCHEMBL7662861 0.84 ALDH1A1 (0.41) TDP1L3MBTL1LMNA
SCHEMBL7662857 0.84 ALDH1A1 (0.41) TDP1L3MBTL1LMNA
SCHEMBL7662937 0.82 LMNA (0.43) KMT2ATDP1MAPTRAB9APOLB
SCHEMBL7662940 0.82 LMNA (0.43) KMT2ATDP1MAPTRAB9APOLB
SCHEMBL9681226 0.82 NPC1 (0.43) KMT2ATDP1L3MBTL1TSHRMAPT
SCHEMBL9262554 0.82 HIF1A (0.50) TDP1L3MBTL1TSHR
SCHEMBL7172808 0.82 HIF1A (0.50) TDP1L3MBTL1TSHR

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-4952720-A Ortho-substituted benzyl carboxylates and fungicides which contain these compounds BASF AKTIENGSELLSCHAFT (DE) 1990-08-28 US disclosed