SCHEMBL10276697

SCHEMBL10276697

C[Si](C)(C)CCOCn1cnc(-c2ccc(Br)cc2F)n1

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 3/20 0.59
ALOX5AP P20292 6/20 0.36
FEN1 P39748 6/20 0.36
HDAC1 Q13547 2/20 0.33
HDAC6 Q9UBN7 2/20 0.33
HDAC4 P56524 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC11 Q96DB2 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
MTOR P42345 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
SCHEMBL1441262 0.87 DGAT1 (0.45) DGAT1NPC1
SCHEMBL10276731 0.86 DGAT1 (0.45) DGAT1
SCHEMBL3508159 0.81 DGAT1 (0.40) DGAT1HDAC1HDAC6NPC1RAB9A
SCHEMBL30722053 0.80 DGAT1 (0.41) DGAT1ALOX5APFEN1HDAC1HDAC6
SCHEMBL10276518 0.80 DGAT1 (0.41) DGAT1ALOX5APFEN1HDAC1HDAC6
SCHEMBL1440492 0.80 DGAT1 (0.40) DGAT1ALOX5APFEN1
SCHEMBL1785976 0.79 DGAT1 (0.39) DGAT1HDAC1HDAC6NPC1RAB9A
SCHEMBL12374018 0.78 DGAT1 (0.41) DGAT1ALOX5APFEN1HDAC1HDAC6
SCHEMBL16661007 0.78 DGAT1 (0.66) DGAT1ALOX5APFEN1
SCHEMBL16660890 0.77 DGAT1 (0.80) DGAT1ALOX5APFEN1NPC1

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-8865726-B2 Substituted pyrazolo[1,5-a]pyrimidine compounds as mTOR inhibitors ARRAY BIOPHARMA INC. (US) 2014-10-21 US disclosed
US-20120178715-A1 SUBSTITUTED PYRAZOLO[1,5-a]PYRIMIDINE COMPOUNDS AS mTOR INHIBITORS ARRAY BIOPHARMA INC. (US) 2012-07-12 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-20120178715-A1 SUBSTITUTED PYRAZOLO[1,5-a]PYRIMIDINE COMPOUNDS AS mTOR INHIBITORS MTOR, RICTOR, EIF4EBP1 DGAT1 4722/4885ALOX5AP 4173/4885FEN1 1631/4885

“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.