SCHEMBL12995180

SCHEMBL12995180

CC(C)(C)[Si](C)(C)OC[C@H]1OC[C@@H](n2cc(F)c(NC(=O)c3ccccc3)nc2=O)S1

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.35
KMT2A Q03164 1/20 0.35
CYP3A4 P08684 4/20 0.34
ABL1 P00519 1/20 0.33
RIN1 Q13671 1/20 0.33
DCK P27707 2/20 0.33
POLB P06746 1/20 0.33
CYP2C9 P11712 2/20 0.32
P2RY6 Q15077 3/20 0.32
P2RY14 Q15391 3/20 0.32
NT5E P21589 2/20 0.32
MAPT P10636 2/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C19 P33261 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
NTRK1 P04629 2/20 0.32
HTT P42858 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
SCHEMBL13881305 1.00 LMNA (0.35) LMNAKMT2ACYP3A4ABL1RIN1
SCHEMBL12995194 0.91 CYP3A4 (0.34) LMNAKMT2ACYP3A4ABL1RIN1
SCHEMBL13881304 0.91 CYP3A4 (0.34) LMNAKMT2ACYP3A4ABL1RIN1
SCHEMBL13881205 0.87 LMNA (0.36) LMNAKMT2ACYP3A4ABL1RIN1
SCHEMBL13881206 0.87 LMNA (0.36) LMNAKMT2ACYP3A4ABL1RIN1
SCHEMBL3621141 0.87 POLB (0.38) LMNAKMT2AABL1RIN1DCK
SCHEMBL16639153 0.87 POLB (0.38) LMNAKMT2AABL1RIN1DCK
SCHEMBL3621139 0.87 POLB (0.38) LMNAKMT2AABL1RIN1DCK
SCHEMBL3654823 0.87 POLB (0.38) LMNAKMT2AABL1RIN1DCK
SCHEMBL13881298 0.87 POLB (0.38) LMNAKMT2AABL1RIN1DCK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2190839-B1 A PROCESS FOR CHIRAL RESOLUTION OF 2-SUBSTITUTED 4-SUBSTITUTED 1,3-OXATHIOLANES AVEXA LTD (AU) 2015-04-15 EP disclosed
US-8318934-B2 Process for chiral resolution of 2-substituted 4-substituted 1,3-oxathiolanes AVEXA LIMITED (AU) 2012-11-27 US disclosed
US-8318934-B2 Process for chiral resolution of 2-substituted 4-substituted 1,3-oxathiolanes AVEXA LIMITED (AU) 2012-11-27 US disclosed
US-20100305321-A1 PROCESS FOR CHIRAL RESOLUTION OF 2-SUBSTITUTED 4-SUBSTITUTED 1,3-OXATHIOLANES AVEXA LIMITED (AU) 2010-12-02 US disclosed
US-20100305321-A1 PROCESS FOR CHIRAL RESOLUTION OF 2-SUBSTITUTED 4-SUBSTITUTED 1,3-OXATHIOLANES AVEXA LIMITED (AU) 2010-12-02 US disclosed
WO-2009039582-A1 A PROCESS FOR CHIRAL RESOLUTION OF 2-SUBSTITUTED 4-SUBSTITUTED 1,3-OXATHIOLANES AVEXA LIMITED (AU) 2009-04-02 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100305321-A1 PROCESS FOR CHIRAL RESOLUTION OF 2-SUBSTITUTED 4-SUBSTITUTED 1,3-OXATHIOLANES DHPS, ICMT, ORC3 LMNA 4383/4885KMT2A 4117/4885CYP3A4 11/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.