SCHEMBL1966218

SCHEMBL1966218

CC(C)(C)C(O)C(CCCOCc1cccc(Cl)c1F)n1cncn1

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
TDP1 Q9NUW8 2/20 0.48
POLB P06746 1/20 0.40
HSP90AA1 P07900 1/20 0.40
CYP3A4 P08684 1/20 0.31
MAPT P10636 1/20 0.30
PDE2A O00408 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
SCHEMBL1967989 0.82 MAPT (0.47) MEN1KMT2ATDP1POLBHSP90AA1
SCHEMBL2159856 0.79 MEN1 (0.48) MEN1KMT2ATDP1POLBHSP90AA1
SCHEMBL12394775 0.79 MEN1 (0.56) MEN1KMT2ATDP1POLBHSP90AA1
SCHEMBL3119242 0.77 MEN1 (0.54) MEN1KMT2ATDP1POLBHSP90AA1
SCHEMBL1964930 0.76 MEN1 (0.49) MEN1KMT2ATDP1POLBHSP90AA1
SCHEMBL3700015 0.74 MEN1 (0.49) MEN1KMT2ATDP1POLBHSP90AA1
SCHEMBL19304856 0.74 KMT2A (0.74) MEN1KMT2ATDP1POLBHSP90AA1
SCHEMBL1964353 0.74 MEN1 (0.54) MEN1KMT2ATDP1POLBHSP90AA1
SCHEMBL1967149 0.73 MEN1 (0.46) MEN1KMT2ATDP1POLBHSP90AA1
SCHEMBL2161013 0.72 MAPK1 (0.52) MEN1KMT2ATDP1POLBHSP90AA1

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-20110172096-A1 Triazole Compounds, The Use Thereof and Preparations Containing These Compounds BASF SE (DE) 2011-07-14 US disclosed
EP-2334654-A1 TRIAZOLE COMPOUNDS, THE USE THEREOF AND PREPARATIONS CONTAINING THESE COMPOUNDS BASF SE (DE) 2011-06-22 EP disclosed
WO-2010029002-A1 TRIAZOLE COMPOUNDS, THE USE THEREOF AND PREPARATIONS CONTAINING THESE COMPOUNDS BASF SE (DE) 2010-03-18 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-20110172096-A1 Triazole Compounds, The Use Thereof and Preparations Containing These Compounds CYP11B2, CYP3A43, CYP3A5 MEN1 625/4885KMT2A 3160/4885TDP1 1251/4885

“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.