SCHEMBL933307

SCHEMBL933307

C[Si](C)(C)CCOCn1cc(-c2ccc3nc(Cl)ccc3c2)nc1[C@@H]1CCCN1

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 6/20 0.33
HPGD P15428 1/20 0.33
TAAR1 Q96RJ0 2/20 0.32
NR1H4 Q96RI1 1/20 0.32
PDCD1LG2 Q9BQ51 1/20 0.31
CD274 Q9NZQ7 1/20 0.31
KCNH2 Q12809 1/20 0.30
HRH3 Q9Y5N1 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
SCHEMBL933306 1.00 DGAT1 (0.33) DGAT1HPGDTAAR1NR1H4PDCD1LG2
SCHEMBL15368135 0.77 DGAT1 (0.40) DGAT1TAAR1
SCHEMBL1888700 0.77 L3MBTL1 (0.39) DGAT1HPGD
SCHEMBL16105980 0.76 TAAR1 (0.36) DGAT1TAAR1
SCHEMBL16105981 0.76 TAAR1 (0.36) DGAT1TAAR1
Hydrochloric Acid SCHEMBL2813401 0.75 TAAR1 (0.35) DGAT1TAAR1
SCHEMBL20055477 0.71 KLKB1 (0.36) DGAT1TAAR1
SCHEMBL1074616 0.71 CYP3A4 (0.46) KCNH2
Hydrochloric Acid SCHEMBL535924 0.67 L3MBTL1 (0.34) DGAT1TAAR1
SCHEMBL16144076 0.66 GRM1 (0.44)

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
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 DGAT1 1994/4885HPGD 1841/4885TAAR1 3833/4885

“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.