SCHEMBL5992116

SCHEMBL5992116

Oc1ccc(Cl)cc1-c1noc2ccccc12

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 10/20 0.59
ESR2 Q92731 10/20 0.59
HSP90AA1 P07900 3/20 0.50
EPHX2 P34913 1/20 0.47
HIF1A Q16665 2/20 0.47
LMNA P02545 2/20 0.44
MEN1 O00255 2/20 0.44
MAPT P10636 2/20 0.44
HPGD P15428 2/20 0.44
KMT2A Q03164 2/20 0.44
ALOX15 P16050 1/20 0.44
MAPK1 P28482 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
RAB9A P51151 1/20 0.44
AHR P35869 1/20 0.42
FFAR4 Q5NUL3 1/20 0.41
PIM1 P11309 1/20 0.41
GAA P10253 1/20 0.41

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
SCHEMBL31256743 0.79 ESR1 (0.54) ESR1ESR2HSP90AA1HIF1AAHR
SCHEMBL14261867 0.79 ESR1 (0.72) ESR1ESR2HSP90AA1MEN1HPGD
SCHEMBL5989215 0.79 KAT6A (0.55) ESR1ESR2HIF1AMEN1MAPT
SCHEMBL6714356 0.76 ESR1 (0.50) ESR1ESR2HSP90AA1HIF1ALMNA
SCHEMBL28635711 0.75 PTGS1 (0.55) ESR1ESR2EPHX2HIF1AMAPT
SCHEMBL4933522 0.75 ESR1 (0.72) ESR1ESR2HSP90AA1
SCHEMBL4931111 0.75 ESR1 (1.00) ESR1ESR2HSP90AA1MEN1HPGD
SCHEMBL7125896 0.72 ESR1 (0.49) ESR1ESR2HSP90AA1HIF1ALMNA
SCHEMBL24073251 0.72 AHR (0.47) EPHX2LMNAMEN1MAPTHPGD
SCHEMBL21185992 0.72 CDK9 (0.41) HSP90AA1EPHX2LMNAMEN1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060257987-A1 Ppar modulators ELI LILLY AND COMPANY 2006-11-16 US disclosed
EP-1660428-A1 PPAR MODULATORS ELI LILLY AND COMPANY (US) 2006-05-31 EP disclosed
WO-2005019151-A1 PPAR MODULATORS ELI LILLY AND COMPANY (US) 2005-03-03 WO disclosed