SCHEMBL13446154

SCHEMBL13446154

O=C(n1ccnc1)C(F)(F)C(F)(F)C(=O)n1ccnc1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.40
ALDH1A1 P00352 2/20 0.36
EGLN3 Q9H6Z9 1/20 0.34
MAPT P10636 1/20 0.34
CYP24A1 Q07973 1/20 0.34
TBXAS1 P24557 5/20 0.33
FAAH O00519 1/20 0.33
MGLL Q99685 1/20 0.33
CYP19A1 P11511 1/20 0.32
HTT P42858 1/20 0.32
FDPS P14324 1/20 0.32
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
SCHEMBL3027719 0.92 L3MBTL1 (0.38) L3MBTL1ALDH1A1EGLN3MAPTCYP24A1
SCHEMBL999664 0.88 L3MBTL1 (0.36) L3MBTL1ALDH1A1EGLN3MAPTCYP24A1
SCHEMBL156615 0.87 MAPT (0.37) L3MBTL1ALDH1A1EGLN3MAPTCYP24A1
SCHEMBL9610803 0.83 CYP24A1 (0.38) L3MBTL1ALDH1A1EGLN3MAPTCYP24A1
SCHEMBL20996818 0.83 MAPT (0.36) L3MBTL1ALDH1A1EGLN3MAPTCYP24A1
SCHEMBL22160768 0.80 CYP24A1 (0.37) L3MBTL1ALDH1A1EGLN3MAPTCYP24A1
SCHEMBL9612195 0.79 L3MBTL1 (0.42) L3MBTL1ALDH1A1EGLN3MAPTCYP24A1
SCHEMBL7033719 0.79 CYP19A1 (0.37) L3MBTL1ALDH1A1EGLN3MAPTCYP24A1
SCHEMBL19239719 0.79 ALDH1A1 (0.34) L3MBTL1ALDH1A1MAPTCYP24A1TBXAS1
SCHEMBL5314422 0.78 ALDH1A1 (0.36) ALDH1A1EGLN3MAPTCYP24A1TBXAS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8476473-B2 Compound, method for preparing the compound and resist composition containing the compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-07-02 US disclosed
US-8476473-B2 Compound, method for preparing the compound and resist composition containing the compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-07-02 US disclosed
US-20100055609-A1 COMPOUND, METHOD FOR PREPARING THE COMPOUND AND RESIST COMPOSITION CONTAINING THE COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-03-04 US disclosed
US-20100055609-A1 COMPOUND, METHOD FOR PREPARING THE COMPOUND AND RESIST COMPOSITION CONTAINING THE COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-03-04 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-20100055609-A1 COMPOUND, METHOD FOR PREPARING THE COMPOUND AND RESIST COMPOSITION CONTAINING THE COMPOUND AFF1, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, AFF4 L3MBTL1 2267/4885ALDH1A1 3688/4885EGLN3 1478/4885

“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.