SCHEMBL3776287

SCHEMBL3776287

Fc1ccc(C(=Cc2ccccc2Cl)CCl)c(F)c1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 2/20 0.38
NPC1 O15118 2/20 0.38
MAPT P10636 2/20 0.38
RAB9A P51151 2/20 0.38
HPGD P15428 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CES2 O00748 1/20 0.38
CES1 P23141 1/20 0.38
TRPA1 O75762 1/20 0.37
GAA P10253 1/20 0.37
MAPK14 Q16539 2/20 0.36
F2R P25116 1/20 0.35
NR3C2 P08235 1/20 0.33

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
SCHEMBL3662395 1.00 NFE2L2 (0.38) NFE2L2NPC1MAPTRAB9AHPGD
SCHEMBL3662523 0.90 NPC1 (0.39) NPC1MAPTRAB9AHPGDHTT
SCHEMBL3764145 0.90 NPC1 (0.39) NPC1MAPTRAB9AHPGDHTT
SCHEMBL3769989 0.89 ALDH1A1 (0.37) NFE2L2TRPA1GAA
SCHEMBL3662246 0.89 MDM2 (0.40) NFE2L2NPC1MAPTRAB9AHPGD
SCHEMBL1023309 0.89 ALDH1A1 (0.37) NFE2L2TRPA1GAA
SCHEMBL3762718 0.89 MDM2 (0.40) NFE2L2NPC1MAPTRAB9AHPGD
SCHEMBL3782296 0.88 NFE2L2 (0.47) NFE2L2MAPTCES2CES1TRPA1
SCHEMBL3782287 0.88 NFE2L2 (0.47) NFE2L2MAPTCES2CES1TRPA1
SCHEMBL16227956 0.87 NFE2L2 (0.37) NFE2L2NPC1MAPTRAB9AHPGD

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 1 patent. 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

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 825/4885NPC1 4668/4885MAPT 3389/4885

“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.