SCHEMBL6044403

SCHEMBL6044403

CCCCN1CCOc2c(-c3ncco3)cc(C(=O)NCCc3cc(F)cc(F)c3)cc21

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.37
HTT P42858 2/20 0.37
MAPT P10636 4/20 0.34
BACE1 P56817 1/20 0.33
FSHR P23945 1/20 0.33
ALDH1A1 P00352 2/20 0.32
THRB P10828 1/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
KDM4E B2RXH2 1/20 0.32
NPC1 O15118 2/20 0.31
RAB9A P51151 2/20 0.31
RORC P51449 1/20 0.31
DRD2 P14416 2/20 0.31
ROCK2 O75116 1/20 0.31
CNR2 P34972 1/20 0.31
CYSLTR2 Q9NS75 1/20 0.30
CYSLTR1 Q9Y271 1/20 0.30
HTR1A P08908 1/20 0.30

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
SCHEMBL6044266 0.86 BACE1 (0.38) BACE1ROCK2
SCHEMBL6043692 0.86 MAPT (0.36) LMNAHTTMAPTBACE1ALDH1A1
SCHEMBL6044320 0.86 SMN1; SMN2 (0.35) LMNAHTTMAPTBACE1FSHR
SCHEMBL6044247 0.85 MAPT (0.41) LMNAHTTMAPTALDH1A1MEN1
SCHEMBL3350595 0.81 RARB (0.34) DRD2CYSLTR2CYSLTR1
SCHEMBL3349063 0.81 GLRA3 (0.40) KDM4EDRD2ROCK2CYSLTR2CYSLTR1
SCHEMBL13306391 0.79 RARB (0.37) CYSLTR2CYSLTR1
SCHEMBL6044004 0.79 BACE1 (0.37) BACE1
SCHEMBL6043430 0.79 BACE1 (0.38) BACE1
SCHEMBL6045083 0.79 BACE1 (0.38) BACE1

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-20060100196-A1 Substituted amines for the treatment of alzheimer's disease ELAN PHARMACEUTICALS, INC. 2006-05-11 US claimed
US-20060100196-A1 Substituted amines for the treatment of alzheimer's disease ELAN PHARMACEUTICALS, INC. 2006-05-11 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-20060100196-A1 Substituted amines for the treatment of alzheimer's disease BACE1, APP, BACE2 LMNA 736/4885HTT 260/4885MAPT 27/4885

“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.