SCHEMBL12883261

SCHEMBL12883261

CC(CC(=O)N1CCOCC1)c1ccc(OC(F)(F)F)cc1

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CTSS P25774 18/20 0.58
▸ CTSK P43235 8/20 0.57
▸ CTSL P07711 5/20 0.57
▸ MEN1 O00255 1/20 0.56
▸ KMT2A Q03164 1/20 0.56
▸ FKBP1A P62942 1/20 0.54

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
SCHEMBL12883259 0.89 MEN1 (0.54) CTSSCTSKCTSLMEN1KMT2A
SCHEMBL12836704 0.88 MEN1 (0.53) CTSSCTSKCTSLMEN1KMT2A
SCHEMBL12883262 0.86 KDM1A (0.51) CTSSMEN1KMT2A
SCHEMBL17761211 0.84 EPHX2 (0.57) CTSS
SCHEMBL12836703 0.84 EPHX2 (0.57) CTSS
SCHEMBL12883269 0.81 TDP1 (0.52) —
SCHEMBL17338907 0.78 HRH3 (0.64) KMT2AFKBP1A
SCHEMBL12883272 0.76 HPGD (0.55) CTSSCTSKCTSLMEN1KMT2A
SCHEMBL12895102 0.76 FFAR1 (0.53) —
SCHEMBL12836583 0.76 FFAR1 (0.53) —

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-9212155-B2 Compounds advantageous in the treatment of central nervous system diseases and disorders AURIMMED PHARMA, INC. (US) 2015-12-15 — — 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
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 (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-20110046128-A1 NOVEL COMPOUNDS ADVANTAGEOUS IN THE TREATMENT OF CENTRAL NERVOUS SYSTEM DISEASES AND DISORDERS GAP43, CHRNA10, CHRNA6 CTSS 157/4885CTSK 593/4885CTSL 1379/4885

“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.

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