SCHEMBL869294

SCHEMBL869294

CC1(C)OC(C)(C)C(=O)C(c2cc(Br)ccc2OC(F)F)C1=O

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
ALDH1A1 P00352 2/20 0.39
GAA P10253 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
HTR2B P41595 2/20 0.35
LMNA P02545 1/20 0.34
MAPK1 P28482 1/20 0.34
NR1I2 O75469 1/20 0.33
WDR5 P61964 3/20 0.33
TP53 P04637 1/20 0.33
POLB P06746 1/20 0.33
TSHR P16473 1/20 0.33
BACE1 P56817 1/20 0.32
HCRTR1 O43613 1/20 0.32
HCRTR2 O43614 1/20 0.32
MAPT P10636 2/20 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
SCHEMBL419374 0.82 ALDH1A1 (0.39) MEN1KMT2AALDH1A1LMNAMAPK1
SCHEMBL868610 0.77 LMNA (0.39) MEN1KMT2AALDH1A1GAASMN1; SMN2
SCHEMBL867730 0.76 MEN1 (0.35) MEN1KMT2AALDH1A1HTR2BLMNA
SCHEMBL10121195 0.76 MEN1 (0.35) MEN1KMT2AALDH1A1HTR2BLMNA
SCHEMBL3024626 0.76 LMNA (0.40) MEN1KMT2AALDH1A1LMNAMAPK1
SCHEMBL3035400 0.75 LMNA (0.39) MEN1KMT2AALDH1A1SMN1; SMN2LMNA
SCHEMBL867734 0.75 LMNA (0.39) MEN1KMT2AALDH1A1LMNAMAPK1
SCHEMBL410941 0.73 LMNA (0.38) MEN1KMT2AALDH1A1SMN1; SMN2LMNA
SCHEMBL15821710 0.73 MAPK1 (0.37) MEN1KMT2AALDH1A1LMNAMAPK1
SCHEMBL10121185 0.73 PTGER1 (0.35) MEN1KMT2AALDH1A1GAASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8987476-B2 Spiro epoxides as intermediates SYNGENTA LIMITED (GB) 2015-03-24 US disclosed
US-20140135508-A1 SPIRO EPOXIDES AS INTERMEDIATES SYNGENTA LIMITED (GB) 2014-05-15 US disclosed
US-8680299-B2 Spiro epoxides as intermediates SYNGENTA LIMITED (GB) 2014-03-25 US disclosed
US-20120077993-A1 SPIRO EPOXIDES AS INTERMEDIATES SYNGENTA CROP PROTECTION, LLC (US) 2012-03-29 US disclosed
WO-2010136431-A9 SPIRO EPOXIDES AS INTERMEDIATES SYNGENTA LIMITED (GB) 2011-03-10 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 (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-20120077993-A1 SPIRO EPOXIDES AS INTERMEDIATES CYP1A1, CYP2E1, CYP1B1 MEN1 4280/4885KMT2A 4394/4885ALDH1A1 39/4885
US-20140135508-A1 SPIRO EPOXIDES AS INTERMEDIATES CYP1A1, CYP2E1, GSTO1 MEN1 4328/4885KMT2A 4398/4885ALDH1A1 26/4885

“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.