SCHEMBL12895271

SCHEMBL12895271

NC(=O)CC(O)c1cccc(OC(F)(F)F)c1

nearest known ligand 0.68

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.68
TRPM8 Q7Z2W7 1/20 0.47
SCN9A Q15858 3/20 0.45
CTSA P10619 1/20 0.43
EPHX1 P07099 2/20 0.43
MMP12 P39900 1/20 0.43
GPR139 Q6DWJ6 1/20 0.42

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
SCHEMBL22630849 0.84 PLA2G10 (0.53) L3MBTL1TRPM8CTSAEPHX1MMP12
SCHEMBL12895166 0.84 PLA2G10 (0.53) L3MBTL1TRPM8CTSAEPHX1MMP12
SCHEMBL17761208 0.84 PLA2G10 (0.53) L3MBTL1TRPM8CTSAEPHX1MMP12
SCHEMBL22643601 0.82 L3MBTL1 (0.49) L3MBTL1TRPM8CTSAEPHX1MMP12
SCHEMBL12895269 0.82 L3MBTL1 (0.47) L3MBTL1SCN9AEPHX1MMP12
SCHEMBL3405700 0.82 PNMT (0.59) L3MBTL1TRPM8SCN9A
SCHEMBL3443105 0.81 L3MBTL1 (1.00) L3MBTL1TRPM8
SCHEMBL27649238 0.79 TRPM8 (0.49) L3MBTL1TRPM8EPHX1GPR139
SCHEMBL1419364 0.78 PNMT (0.67) L3MBTL1TRPM8EPHX1
SCHEMBL20764626 0.77 KMT2A (0.61) TRPM8CTSAEPHX1MMP12GPR139

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-20210130285-A1 NOVEL COMPOUNDS ADVANTAGEOUS IN THE TREATMENT OF CENTRAL NERVOUS SYSTEM DISEASES AND DISORDERS AURIMMED PHARMA, INC. 2021-05-06 US disclosed
US-10793515-B2 Compounds advantageous in the treatment of central nervous system diseases and disorders AURIMMED PHARMA, INC. (US) 2020-10-06 US disclosed
US-20110046128-A1 NOVEL COMPOUNDS ADVANTAGEOUS IN THE TREATMENT OF CENTRAL NERVOUS SYSTEM DISEASES AND DISORDERS AURIMMED PHARMA, INC. (US) 2011-02-24 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 (3 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-20210130285-A1 NOVEL COMPOUNDS ADVANTAGEOUS IN THE TREATMENT OF CENTRAL NERVOUS SYSTEM DISEASES AND DISORDERS SMN1; SMN2, HDAC6, HDAC3 L3MBTL1 1023/4885TRPM8 409/4885SCN9A 531/4885
US-20110046128-A1 NOVEL COMPOUNDS ADVANTAGEOUS IN THE TREATMENT OF CENTRAL NERVOUS SYSTEM DISEASES AND DISORDERS GAP43, CHRNA10, CHRNA6 L3MBTL1 2159/4885TRPM8 243/4885SCN9A 338/4885
US-10793515-B2 Compounds advantageous in the treatment of central nervous system diseases and disorders SMN1; SMN2, HDAC6, CTSA L3MBTL1 946/4885TRPM8 368/4885SCN9A 477/4885

“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.