SCHEMBL932995

SCHEMBL932995

CC(C)(C)OC(=O)N1CCC[C@H]1c1nc(-c2ccc(-c3cc4ccc(-c5cnc([C@@H]6CCCN6C(=O)OC(C)(C)C)n5COCC[Si](C)(C)C)cc4cn3)nc2)c[nH]1

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 9/20 0.33
DGAT1 O75907 2/20 0.33
CHEK2 O96017 1/20 0.33
HPGDS O60760 2/20 0.32
ALDH1A1 P00352 2/20 0.32
GSK3B P49841 1/20 0.32
DYRK1A Q13627 1/20 0.32
MEN1 O00255 1/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
TSHR P16473 1/20 0.32
HTT P42858 1/20 0.32
KMT2A Q03164 1/20 0.32
NPSR1 Q6W5P4 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
SCHEMBL933276 0.97 GPR119 (0.32) GPR119DGAT1CHEK2HPGDSALDH1A1
SCHEMBL1888132 0.95 HPGDS (0.34) GPR119DGAT1CHEK2HPGDSALDH1A1
SCHEMBL12661154 0.93 CHEK2 (0.34) GPR119DGAT1CHEK2ALDH1A1GSK3B
SCHEMBL933621 0.93 HPGDS (0.34) GPR119DGAT1CHEK2HPGDS
SCHEMBL12661219 0.93 GPR119 (0.36) GPR119DGAT1CHEK2ALDH1A1MEN1
SCHEMBL1888626 0.91 DGAT1 (0.37) GPR119DGAT1CHEK2ALDH1A1MEN1
SCHEMBL1891182 0.91 CHEK2 (0.33) GPR119CHEK2ALDH1A1GSK3BDYRK1A
SCHEMBL1889043 0.90 DGAT1 (0.34) GPR119DGAT1CHEK2HPGDSALDH1A1
SCHEMBL932651 0.88 DGAT1 (0.36) GPR119DGAT1CHEK2ALDH1A1MEN1
SCHEMBL933407 0.88 DGAT1 (0.32) GPR119DGAT1CHEK2HPGDSALDH1A1

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 3 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
WO-2011004276-A1 HEPATITIS C VIRUS INHIBITORS PFIZER LIMITED (GB) 2011-01-13 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-20110112100-A1 Hepatitis C Virus Inhibitors HAVCR2, SLC10A1, HCCS GPR119 2249/4885DGAT1 1994/4885CHEK2 3724/4885

“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.