SCHEMBL24149115

SCHEMBL24149115

C[C@H](NP(=O)(OC[C@H]1O[C@@](C)(c2ccc3c(N)ncnn23)[C@H](O)[C@@H]1O)Oc1ccc(C(C)(C)C)cc1)C(=O)OCC1CCC1

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ DOT1L Q8TEK3 2/20 0.33
▸ CYP3A4 P08684 2/20 0.32
▸ CYP2C9 P11712 2/20 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
SCHEMBL25012742 0.98 DOT1L (0.33) DOT1LCYP3A4CYP2C9
SCHEMBL24148691 0.97 DOT1L (0.34) DOT1LCYP3A4CYP2C9
SCHEMBL24149199 0.93 DOT1L (0.33) DOT1LCYP3A4CYP2C9
SCHEMBL25012732 0.92 CYP3A4 (0.38) CYP3A4CYP2C9
SCHEMBL24148771 0.92 CYP3A4 (0.34) DOT1LCYP3A4CYP2C9
SCHEMBL24148975 0.92 BTN3A1 (0.35) DOT1LCYP3A4CYP2C9
SCHEMBL24148931 0.91 DOT1L (0.33) DOT1LCYP3A4CYP2C9
SCHEMBL24149800 0.91 DOT1L (0.33) DOT1LCYP3A4CYP2C9
SCHEMBL25014033 0.91 DOT1L (0.33) DOT1LCYP3A4CYP2C9
SCHEMBL24149577 0.91 DOT1L (0.33) DOT1LCYP3A4CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021262826-A2 1'-CYANO NUCLEOSIDE ANALOGS AND USES THEREOF GILEAD SCIENCES, INC. (US) 2021-12-30 — — WO disclosed
Send feedback