SCHEMBL6043692

SCHEMBL6043692

CCCCN1CCNc2c(-c3ncco3)cc(C(=O)NCCc3cc(F)cc(F)c3)cc21

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.36
BACE1 P56817 5/20 0.34
LMNA P02545 1/20 0.34
HTT P42858 1/20 0.34
KMT2A Q03164 4/20 0.33
MEN1 O00255 3/20 0.33
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
RAB9A P51151 3/20 0.31
NPC1 O15118 3/20 0.31
CNR2 P34972 1/20 0.31
RXFP1 Q9HBX9 1/20 0.30
HPGDS O60760 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
SCHEMBL6044229 0.86 BACE1 (0.37) BACE1
SCHEMBL6044403 0.86 LMNA (0.37) MAPTBACE1LMNAHTTKMT2A
SCHEMBL6044320 0.86 SMN1; SMN2 (0.35) MAPTBACE1LMNAHTTKMT2A
SCHEMBL6044247 0.85 MAPT (0.41) MAPTLMNAHTTKMT2AMEN1
SCHEMBL6043698 0.79 BACE1 (0.37) BACE1
SCHEMBL6044267 0.79 BACE1 (0.37) BACE1
SCHEMBL6044471 0.79 BACE1 (0.39) BACE1
SCHEMBL6044958 0.79 BACE1 (0.37) BACE1
SCHEMBL6043542 0.77 BACE1 (0.36) BACE1
SCHEMBL6044130 0.76 NTRK1 (0.36) 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 4 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
EP-1430032-A2 SUBSTITUTED AMIDES FOR THE TREATMENT OF NEUROLOGICAL DISORDERS Elan Pharmaceuticals, Inc. (US) 2004-06-23 EP claimed
WO-2003027068-A2 SUBSTITUTED AMINES FOR THE TREATMENT OF NEUROLOGICAL DISORDERS ELAN PHARMACEUTICALS, INC. (US) 2003-04-03 WO 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 MAPT 27/4885BACE1 1/4885LMNA 736/4885

“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.