SCHEMBL18243182

SCHEMBL18243182

CC(C)[CH]c1cccc(C(F)(F)C(F)(F)F)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 1/20 0.40
FBP1 P09467 1/20 0.35
HTR2A P28223 1/20 0.34
HTR2C P28335 1/20 0.34
HTR2B P41595 1/20 0.34
IDO1 P14902 1/20 0.32
TDO2 P48775 1/20 0.32
MAOB P27338 2/20 0.31
HTT P42858 1/20 0.31
THRB P10828 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MAOA P21397 1/20 0.31
NPSR1 Q6W5P4 2/20 0.31
P4HB P07237 2/20 0.31
TTR P02766 1/20 0.31
PIM1 P11309 1/20 0.31
CISD1 Q9NZ45 1/20 0.31
PIM2 Q9P1W9 1/20 0.31
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31

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
SCHEMBL18378088 0.90 NFE2L2 (0.38) NFE2L2FBP1HTR2AHTR2CHTR2B
SCHEMBL18242878 0.88 NFE2L2 (0.37) NFE2L2FBP1HTR2AHTR2CHTR2B
SCHEMBL18242242 0.85 NFE2L2 (0.54) NFE2L2FBP1HTR2AHTR2CHTR2B
SCHEMBL18242261 0.81 TSHR (0.38) NFE2L2FBP1
SCHEMBL18242080 0.79 NFE2L2 (0.43) NFE2L2FBP1MAOBHTTTHRB
SCHEMBL18378484 0.77 PDE2A (0.33)
SCHEMBL18242898 0.76 NFE2L2 (0.41) NFE2L2FBP1HTR2AHTR2CHTR2B
SCHEMBL17103563 0.76 ALDH1A1 (0.45) NFE2L2FBP1MAOBL3MBTL1MAOA
SCHEMBL18243573 0.75 NFE2L2 (0.33) NFE2L2
SCHEMBL18242350 0.74 NFE2L2 (0.39) NFE2L2FBP1HTR2AHTR2CHTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10451967-B2 Acid- and radical-generating agent and method for generating acid and radical FUJIFILM WAKO PURE CHEMICAL CORPORATION (JP) 2019-10-22 US disclosed
US-20160342084-A1 ACID- AND RADICAL-GENERATING AGENT AND METHOD FOR GENERATING ACID AND RADICAL FUJIFILM WAKO PURE CHEMICAL CORPORATION (JP) 2016-11-24 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-10451967-B2 Acid- and radical-generating agent and method for generating acid and radical CBR1, HAO2, CBR3 NFE2L2 45/4885FBP1 3519/4885HTR2A 2430/4885
US-20160342084-A1 ACID- AND RADICAL-GENERATING AGENT AND METHOD FOR GENERATING ACID AND RADICAL CBR1, HAO2, CBR3 NFE2L2 45/4885FBP1 3519/4885HTR2A 2430/4885

“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.