SCHEMBL9555779

SCHEMBL9555779

CC(C)(C)[Si](OC[C@H](CO)OCP(=O)(O)O)(c1ccccc1)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 1/20 0.38
SLC22A6 Q4U2R8 1/20 0.37
TYMP P19971 1/20 0.37
CYP3A4 P08684 1/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
SMYD2 Q9NRG4 2/20 0.31
TSHR P16473 2/20 0.31
GAA P10253 2/20 0.30
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
PKM P14618 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL9555783 1.00 FGFR1 (0.38) FGFR1SLC22A6TYMPCYP3A4HTT
SCHEMBL9555572 0.85 PPARA (0.36) CYP3A4HTTSMN1; SMN2TSHR
SCHEMBL9555574 0.85 PPARA (0.36) CYP3A4HTTSMN1; SMN2TSHR
SCHEMBL9655148 0.81 HTT (0.40) CYP3A4HTTSMN1; SMN2SMYD2TSHR
SCHEMBL34465055 0.81 PRKCA (0.34) CYP3A4HTTSMN1; SMN2TSHRMEN1
SCHEMBL20254087 0.80 CYP2C9 (0.41) CYP3A4HTTSMN1; SMN2SMYD2TSHR
SCHEMBL9009116 0.80 CYP2C9 (0.41) CYP3A4HTTSMN1; SMN2SMYD2TSHR
SCHEMBL28665561 0.77 SMN1; SMN2 (0.37) CYP3A4HTTSMN1; SMN2SMYD2PKM
SCHEMBL28665559 0.77 SMN1; SMN2 (0.37) CYP3A4HTTSMN1; SMN2SMYD2PKM
SCHEMBL21873649 0.75 CYP1A2 (0.42) CYP3A4HTTSMN1; SMN2TSHRMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5247085-A Phosphonate containing purine compounds BEECHAM GROUP P.L.C. (GB) 1993-09-21 US disclosed
EP-0405748-A1 Phosphonoderivative of purine with antiviral activity Beecham Group p.l.c. (GB) 1991-01-02 EP disclosed