SCHEMBL9563108

SCHEMBL9563108

Oc1cccc2c(Oc3ccc(Cl)cc3Cl)cccc12

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 5/20 0.62
SLC6A2 P23975 3/20 0.62
SLC6A3 Q01959 3/20 0.62
MAPT P10636 2/20 0.62
NR1I2 O75469 1/20 0.62
LMNA P02545 1/20 0.62
PGR P06401 1/20 0.62
HSP90AA1 P07900 1/20 0.62
ADORA3 P0DMS8 1/20 0.62
HSPA5 P11021 1/20 0.62
HPGD P15428 1/20 0.62
CBR1 P16152 1/20 0.62
TBXA2R P21731 1/20 0.62
AGTR1 P30556 1/20 0.62
ESR1 P03372 2/20 0.59
ESR2 Q92731 2/20 0.59
RHEB Q15382 1/20 0.56
CHRM1 P11229 1/20 0.48
ESRRA P11474 1/20 0.46
PLA2G1B P04054 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
SCHEMBL240470 0.83 TTR (0.76) TTRSLC6A2SLC6A3MAPTNR1I2
SCHEMBL9710713 0.81 AR (0.58) TTRSLC6A2SLC6A3MAPTNR1I2
SCHEMBL9644001 0.81 STK39 (0.47) HPGDESR1ESR2ESRRAMRGPRX4
SCHEMBL9656908 0.79 TTR (0.60) TTRSLC6A2SLC6A3MAPTNR1I2
SCHEMBL3305793 0.78 TTR (0.62) TTRSLC6A2SLC6A3MAPTNR1I2
Triclosan SCHEMBL526378 0.77 TTR (1.00) TTRSLC6A2SLC6A3MAPTNR1I2
Triclosan SCHEMBL29367506 0.77 TTR (1.00) TTRSLC6A2SLC6A3MAPTNR1I2
Triclosan SCHEMBL29356111 0.77 TTR (1.00) TTRSLC6A2SLC6A3MAPTNR1I2
Triclosan SCHEMBL29354475 0.77 TTR (1.00) TTRSLC6A2SLC6A3MAPTNR1I2
Triclosan SCHEMBL3269 0.77 TTR (1.00) TTRSLC6A2SLC6A3MAPTNR1I2

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
JP-5286899-A None JP disclosed
JP-H05286899-A ALPHA-(5-DICHLOROPHENOXY-NAPHTHALEN-1-YL-OXY)PROPIONIC ACID DERIVATIVES BAYER AG 1993-11-02 JP disclosed
EP-0534239-A2 Derivatives of alpha-(5-dichlorphenoxy-naphthalen-1-yl-oxy)propionic acid as herbicides BAYER AG (DE) 1993-03-31 EP disclosed