SCHEMBL11298326

SCHEMBL11298326

CCCCCCCCC(CO)(c1ccccc1)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 2/20 0.47
ESR2 Q92731 2/20 0.47
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
TNNC1 P63316 5/20 0.40
S1PR1 P21453 2/20 0.40
SIGMAR1 Q99720 2/20 0.40
SGPL1 O95470 1/20 0.40
S1PR4 O95977 1/20 0.40
GPR183 P32249 1/20 0.40
CERS2 Q96G23 1/20 0.40
S1PR3 Q99500 1/20 0.40
S1PR5 Q9H228 1/20 0.40
GAA P10253 1/20 0.40
ATM Q13315 1/20 0.39
SCN5A Q14524 3/20 0.39
SCN9A Q15858 3/20 0.39
EBP Q15125 1/20 0.39
SOAT1 P35610 2/20 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
SCHEMBL11301244 0.92 ESR1 (0.55) ESR1ESR2MEN1KMT2ASIGMAR1
SCHEMBL10448023 0.88 ESR1 (0.53) ESR1ESR2MEN1KMT2ASIGMAR1
SCHEMBL8978824 0.88 ESR1 (0.53) ESR1ESR2MEN1KMT2ASIGMAR1
SCHEMBL4740369 0.88 ESR1 (0.53) ESR1ESR2MEN1KMT2ASIGMAR1
SCHEMBL7781763 0.86 ESR1 (0.55) ESR1ESR2MEN1KMT2ASIGMAR1
SCHEMBL8158952 0.84 ESR1 (0.59) ESR1ESR2MEN1KMT2ASIGMAR1
SCHEMBL5200056 0.84 ESR1 (0.70) ESR1ESR2
SCHEMBL8052267 0.84 ESR1 (0.70) ESR1ESR2
SCHEMBL17923963 0.82 ESR1 (0.52) ESR1ESR2MEN1KMT2ASIGMAR1
SCHEMBL8314216 0.82 CHRM3 (0.38) ESR1ESR2SIGMAR1GAA

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
EP-0008796-B1 POLYPHOSPHAZENE POLYMERS CONTAINING ALKOXY SUBSTITUENTS CONTAINING A FULLY SUBSTITUTED CARBON IN THE BETA POSITION AND PROCESS FOR THEIR PREPARATION THE FIRESTONE TIRE & RUBBER COMPANY (US) 1982-03-24 EP disclosed
US-4264759-A Polyphosphazene polymers containing alkoxy substitutents containing a fully substituted carbon in the beta position THE FIRESTONE TIRE & RUBBER COMPANY (US) 1981-04-28 US disclosed
EP-0008796-A1 Polyphosphazene polymers containing alkoxy substituents containing a fully substituted carbon in the beta position and process for their preparation THE FIRESTONE TIRE & RUBBER COMPANY (US) 1980-03-19 EP disclosed