SCHEMBL1885778

SCHEMBL1885778

CC(C)(C)OC(=O)N1CCC[C@H]1c1ncc(-c2ccc(-c3ccc4cc(O[Si](C)(C)C(C)(C)C)ccc4c3)nc2)n1COCC[Si](C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 3/20 0.35
GPR119 Q8TDV5 6/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
KDM4E B2RXH2 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
CHEK2 O96017 1/20 0.34
SPHK2 Q9NRA0 2/20 0.33
SPHK1 Q9NYA1 2/20 0.33
USP30 Q70CQ3 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
ALDH1A1 P00352 2/20 0.33
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
TSHR P16473 1/20 0.33
KMT2A Q03164 1/20 0.33
MAPT P10636 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33

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
SCHEMBL12661149 0.94 GPR119 (0.36) GPR119L3MBTL1KDM4ENPC1RAB9A
SCHEMBL934514 0.93 SPHK2 (0.37) GPR119L3MBTL1KDM4ENPC1RAB9A
SCHEMBL933620 0.93 DGAT1 (0.36) DGAT1SPHK2SPHK1MAPT
SCHEMBL1888626 0.93 DGAT1 (0.37) DGAT1GPR119L3MBTL1KDM4ENPC1
SCHEMBL932651 0.90 DGAT1 (0.36) DGAT1GPR119L3MBTL1KDM4ENPC1
SCHEMBL1888828 0.90 DGAT1 (0.36) DGAT1GPR119L3MBTL1KDM4ENPC1
SCHEMBL12661219 0.89 GPR119 (0.36) DGAT1GPR119L3MBTL1CHEK2HDAC8
SCHEMBL933254 0.89 DGAT1 (0.37) DGAT1GPR119L3MBTL1KDM4ENPC1
SCHEMBL933906 0.87 SPHK2 (0.36) DGAT1SPHK2SPHK1
SCHEMBL12661239 0.87 ALDH1A1 (0.36) GPR119L3MBTL1KDM4ENPC1RAB9A

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-20110112100-A1 Hepatitis C Virus Inhibitors PFIZER INC. 2011-05-12 US disclosed
US-20110112100-A1 Hepatitis C Virus Inhibitors PFIZER INC. 2011-05-12 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-20110112100-A1 Hepatitis C Virus Inhibitors HAVCR2, SLC10A1, HCCS DGAT1 1994/4885GPR119 2249/4885L3MBTL1 3963/4885

“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.