SCHEMBL5953932

SCHEMBL5953932

CC1(C)O[C@@H]2[C@H](O1)[C@H](CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)O[C@H]2c1cccnc1F

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.34
SMYD2 Q9NRG4 2/20 0.33
CYP3A4 P08684 1/20 0.32

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
SCHEMBL8860952 0.82 ALDH1A1 (0.40) ALDH1A1SMYD2CYP3A4
SCHEMBL4309745 0.77 ALDH1A1 (0.42) ALDH1A1SMYD2CYP3A4
SCHEMBL866009 0.77 ALDH1A1 (0.42) ALDH1A1SMYD2CYP3A4
SCHEMBL12936593 0.77 ALDH1A1 (0.42) ALDH1A1SMYD2CYP3A4
SCHEMBL12277057 0.77 ALDH1A1 (0.42) ALDH1A1SMYD2CYP3A4
SCHEMBL16707269 0.77 ALDH1A1 (0.42) ALDH1A1SMYD2CYP3A4
SCHEMBL19464883 0.77 ALDH1A1 (0.42) ALDH1A1SMYD2CYP3A4
SCHEMBL12803239 0.77 ALDH1A1 (0.42) ALDH1A1SMYD2CYP3A4
SCHEMBL8861117 0.77 ALDH1A1 (0.36) ALDH1A1SMYD2CYP3A4
SCHEMBL8861116 0.77 ALDH1A1 (0.36) ALDH1A1SMYD2CYP3A4

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
EP-0948511-B1 CHEMICAL SYNTHESIS OF NUCLEOSIDES ANALOGS AND THEIR INCORPORATION INTO POLYNUCLEOTIDES SIRNA THERAPEUTICS INC (US) 2006-10-18 EP disclosed
US-6248878-B1 INCLUDING BASES 2-FLUOROPYRIDINE-3-YL, PYRIDINE-2-ONE-3-YL, PYRIDIN-2-(4-NITROPHENYLETHYL)-ONE-3-YL, 2-BROMOPYRIDINE-5-YL , PYRIDIN-2-ONE-5-YL, 2-AMINOPYRIDINE-5-YL, PYRIDIN-2-(4-NITROPHENYLETHYL)-ONE-5-YL; ANTISENSE/ANTICANCER AGENTS RIBOZYME PHARMACEUTICALS, INC. 2001-06-19 US disclosed