SCHEMBL7600701

SCHEMBL7600701

CC(=O)N1CCC(CN2OCC(C)(CC(C)C)NC2=N)CC1

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.32
EPHX2 P34913 1/20 0.32
FEN1 P39748 1/20 0.31
HTR3A P46098 1/20 0.30
HTR4 Q13639 1/20 0.30
PIK3CD O00329 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
SCHEMBL17551647 0.76 PIK3CD (0.30) PIK3CD
SCHEMBL7520536 0.73 KMT2A (0.36) FEN1HTR3AHTR4PIK3CD
SCHEMBL17715590 0.72 ADAMTS5 (0.32) EPHX1EPHX2FEN1HTR3AHTR4
SCHEMBL17551591 0.72 FEN1 (0.31) FEN1HTR3AHTR4PIK3CD
SCHEMBL7519592 0.67 SMN1; SMN2 (0.36) PIK3CD
SCHEMBL8265223 0.67 BACE1 (0.33) EPHX1EPHX2FEN1HTR3AHTR4
SCHEMBL7521703 0.64 SMN1; SMN2 (0.34)
SCHEMBL7525542 0.63 FASN (0.39)
SCHEMBL7553079 0.63 HTT (0.47) FEN1
SCHEMBL7520662 0.62 KMT2A (0.36)

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-8183252-B2 Heterocyclic aspartyl protease inhibitors SCHERING CORPORATION (US) 2012-05-22 US disclosed
US-20100292203-A1 HETEROCYCLIC ASPARTYL PROTEASE INHIBITORS SCHERING CORPORATION 2010-11-18 US disclosed
US-7592348-B2 Heterocyclic aspartyl protease inhibitors SCHERING CORPORATION (US) 2009-09-22 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-20100292203-A1 HETEROCYCLIC ASPARTYL PROTEASE INHIBITORS CHRM1, CHRM2, PRSS1 EPHX1 765/4885EPHX2 821/4885FEN1 4155/4885

“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.