SCHEMBL84164

SCHEMBL84164

C[Si](C)(C)CCOCn1cc(Br)nc1-c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 12/20 0.56
BRD4 O60885 1/20 0.44
KDM4E B2RXH2 1/20 0.36
PDE10A Q9Y233 1/20 0.35
ALDH1A1 P00352 1/20 0.35
POLB P06746 1/20 0.35
HTT P42858 1/20 0.35
HPGD P15428 1/20 0.35
NR1H2 P55055 1/20 0.35
NR1H3 Q13133 1/20 0.35

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
SCHEMBL6982067 0.88 DGAT1 (0.58) DGAT1BRD4ALDH1A1HPGD
SCHEMBL6982954 0.82 DGAT1 (0.58) DGAT1KDM4EALDH1A1POLBHTT
SCHEMBL15050223 0.82 DGAT1 (0.47) DGAT1BRD4ALDH1A1
SCHEMBL16661146 0.82 DGAT1 (0.66) DGAT1BRD4PDE10A
SCHEMBL17810246 0.81 DGAT1 (0.62) DGAT1BRD4PDE10A
SCHEMBL12963688 0.80 DGAT1 (0.50) DGAT1PDE10A
SCHEMBL67976 0.80 DGAT1 (0.50) DGAT1BRD4PDE10A
SCHEMBL27338948 0.80 DGAT1 (0.54) DGAT1BRD4PDE10A
SCHEMBL23123637 0.78 DGAT1 (0.46) DGAT1BRD4PDE10A
SCHEMBL616813 0.78 DGAT1 (0.48) DGAT1PDE10A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8865732-B2 Heterocyclic compounds and uses thereof NOVARTIS AG (CH) 2014-10-21 US disclosed
US-20130210818-A1 Novel Heterocyclic Compounds and Uses Thereof NOVARTIS AG (CH) 2013-08-15 US disclosed
US-8129394-B2 Heteroaryl-substituted imidazole compounds and uses thereof NOVARTIS AG (CH) 2012-03-06 US disclosed
US-20100003246-A1 Novel heterocyclic compounds and uses therof NOVARTIS AG (CH) 2010-01-07 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 (2 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-20100003246-A1 Novel heterocyclic compounds and uses therof BRAF, ARAF, KRAS DGAT1 3367/4885BRD4 182/4885KDM4E 3041/4885
US-20130210818-A1 Novel Heterocyclic Compounds and Uses Thereof BRAF, RAF1, HRAS DGAT1 2240/4885BRD4 192/4885KDM4E 2526/4885

“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.