SCHEMBL3664086

SCHEMBL3664086

COc1cc(F)ccc1/C(=C/c1ccccc1F)CCl

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 4/20 0.46
AR P10275 1/20 0.40
MEN1 O00255 2/20 0.36
MAPT P10636 2/20 0.36
KMT2A Q03164 2/20 0.36
PLIN1 O60240 1/20 0.36
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.36
PLIN5 Q00G26 1/20 0.36
ABHD5 Q8WTS1 1/20 0.36
PARP15 Q460N3 1/20 0.36
PARP10 Q53GL7 1/20 0.36
RELA Q04206 1/20 0.36
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
NPC1 O15118 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HTT P42858 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
SCHEMBL3772509 1.00 NFE2L2 (0.46) NFE2L2ARMEN1MAPTKMT2A
SCHEMBL3659247 0.89 AR (0.39) NFE2L2ARMEN1MAPTKMT2A
SCHEMBL3821269 0.89 AR (0.39) NFE2L2ARMEN1MAPTKMT2A
SCHEMBL3662315 0.89 ABCG2 (0.44) NFE2L2ARMEN1MAPTKMT2A
SCHEMBL3662316 0.89 ABCG2 (0.44) NFE2L2ARMEN1MAPTKMT2A
SCHEMBL3782287 0.84 NFE2L2 (0.47) NFE2L2MAPTPOLBTDP1L3MBTL1
SCHEMBL3782296 0.84 NFE2L2 (0.47) NFE2L2MAPTPOLBTDP1L3MBTL1
SCHEMBL3662353 0.81 NFE2L2 (0.41) NFE2L2MAPTNPC1SMN1; SMN2HTT
SCHEMBL3769663 0.81 NFE2L2 (0.41) NFE2L2MAPTNPC1SMN1; SMN2HTT
SCHEMBL3768892 0.81 NFE2L2 (0.47) NFE2L2ARNPC1

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-20100317515-A1 Azolylmethyloxiranes, use Thereof and Agents Containing the Same BASF SE (DE) 2010-12-16 US disclosed
EP-2234488-A2 AZOLYLMETHYLOXIRANES, USE THEREOF AND AGENTS CONTAINING THE SAME BASF SE (DE) 2010-10-06 EP disclosed
WO-2009077443-A2 AZOLYLMETHYLOXIRANES, USE THEREOF AND AGENTS CONTAINING THE SAME BASF SE (DE) 2009-06-25 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-20100317515-A1 Azolylmethyloxiranes, use Thereof and Agents Containing the Same XDH, NOX5, TET1 NFE2L2 825/4885AR 3658/4885MEN1 1724/4885

“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.