SCHEMBL12410230

SCHEMBL12410230

CC(=O)N1CC[C@H](CN2C(=N)NC(C)(c3cccc(-c4cccc(Cl)c4)c3)C2=O)C1

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FASN P49327 14/20 0.50
BACE1 P56817 4/20 0.48
CTSD P07339 1/20 0.48
BRD4 O60885 1/20 0.39
CREBBP Q92793 1/20 0.39

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
SCHEMBL7537723 1.00 FASN (0.50) FASNBACE1CTSDBRD4CREBBP
SCHEMBL7544375 0.95 BACE1 (0.53) FASNBACE1CTSDBRD4CREBBP
SCHEMBL7546538 0.92 BACE1 (0.48) FASNBACE1CTSDBRD4CREBBP
SCHEMBL2969191 0.90 FASN (0.47) FASNBACE1CTSD
SCHEMBL8199131 0.90 FASN (0.47) FASNBACE1CTSD
SCHEMBL2969188 0.90 FASN (0.47) FASNBACE1CTSD
SCHEMBL12173774 0.90 FASN (0.47) FASNBACE1CTSD
SCHEMBL12496331 0.90 FASN (0.39) FASNBACE1CTSDBRD4
SCHEMBL2967070 0.89 FASN (0.57) FASN
SCHEMBL2967073 0.89 FASN (0.57) FASN

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-7973067-B2 Heterocyclic aspartyl protease inhibitors SCHERING CORPORATION (US) 2011-07-05 US disclosed
US-7973067-B2 Heterocyclic aspartyl protease inhibitors SCHERING CORPORATION (US) 2011-07-05 US disclosed
US-20090258868-A1 HETEROCYCLIC ASPARTYL PROTEASE INHIBITORS SCHERING CORPORATION 2009-10-15 US disclosed
US-20090258868-A1 HETEROCYCLIC ASPARTYL PROTEASE INHIBITORS SCHERING CORPORATION 2009-10-15 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-20090258868-A1 HETEROCYCLIC ASPARTYL PROTEASE INHIBITORS CHRM1, CHRM2, PRSS1 FASN 3111/4885BACE1 8/4885CTSD 13/4885

“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.