SCHEMBL13675445

SCHEMBL13675445

CNCC(N)C1CCCC1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.36
SHBG P04278 1/20 0.36
DPP4 P27487 1/20 0.35
ANPEP P15144 3/20 0.33
ERAP2 Q6P179 2/20 0.33
TP53 P04637 1/20 0.33
KDM4E B2RXH2 1/20 0.32

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
SCHEMBL3724615 0.98 EPHX1 (0.39) EPHX1SHBGDPP4ANPEPERAP2
SCHEMBL13675449 0.95
SCHEMBL13675439 0.90
SCHEMBL13675428 0.82 CARM1 (0.32) ANPEP
SCHEMBL13673902 0.79 EPHX1 (0.34) EPHX1SHBGDPP4ANPEPERAP2
SCHEMBL13673867 0.77 EPHX1 (0.38) EPHX1SHBGDPP4ANPEPERAP2
SCHEMBL28291254 0.77 SIGMAR1 (0.39) EPHX1SHBGDPP4TP53KDM4E
SCHEMBL24181063 0.76 ANPEP (0.31) ANPEP
SCHEMBL8227004 0.74 ANPEP (0.31) ANPEP
SCHEMBL13673865 0.74 DPP4 (0.31) EPHX1SHBGDPP4

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090247519-A1 AMINO-ETHYL-AMINO-ARYL (AEAA) COMPOUNDS AND THEIR USE CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2009-10-01 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-20090247519-A1 AMINO-ETHYL-AMINO-ARYL (AEAA) COMPOUNDS AND THEIR USE PKD2, PKD1, AADAT EPHX1 1379/4885SHBG 4484/4885DPP4 1106/4885

“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.