SCHEMBL12995158

SCHEMBL12995158

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

nearest known ligand 0.31

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DCK P27707 1/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
TSHR P16473 1/20 0.31
MAPK1 P28482 1/20 0.31
HTT P42858 1/20 0.31
NLRP3 Q96P20 1/20 0.30
NPC1 O15118 1/20 0.30
POLB P06746 1/20 0.30
MAPT P10636 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL12995154 1.00 DCK (0.31) DCKMEN1KMT2AKDM4EALDH1A1
SCHEMBL12995146 0.93 ALDH1A1 (0.35) DCKMEN1KMT2AALDH1A1HTT
SCHEMBL12995147 0.93 ALDH1A1 (0.35) DCKMEN1KMT2AALDH1A1HTT
SCHEMBL14039219 0.88 KMT2A (0.35) DCKMEN1KMT2AKDM4EALDH1A1
SCHEMBL12995176 0.87 TOP2A (0.30)
SCHEMBL12995198 0.87
SCHEMBL12995199 0.87
SCHEMBL12995168 0.87 ALB (0.37) DCKMEN1KMT2AKDM4EALDH1A1
SCHEMBL12995169 0.87 ALB (0.37) DCKMEN1KMT2AKDM4EALDH1A1
SCHEMBL13881206 0.85 LMNA (0.36) DCKKMT2AHTTPOLBMAPT

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-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

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 DCK 2444/4885MEN1 4210/4885KMT2A 4117/4885

“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.