SCHEMBL9102145

SCHEMBL9102145

CC(C)(C)OC(=O)N[C@H](C(=O)N1CCC1)C1CC1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
AAK1 Q2M2I8 2/20 0.44
CTSL P07711 3/20 0.43
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CTSK P43235 3/20 0.40
CTSB P07858 1/20 0.40
ITGB3 P05106 7/20 0.40
ITGA2B P08514 7/20 0.40
TSHR P16473 1/20 0.39
HPGD P15428 1/20 0.39
PREP P48147 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
SCHEMBL9102139 1.00 AAK1 (0.44) AAK1CTSLCA1CA2CTSK
SCHEMBL18215087 0.97 AAK1 (0.44) AAK1CTSLCA1CA2CTSK
SCHEMBL28650981 0.97 AAK1 (0.44) AAK1CTSLCA1CA2CTSK
SCHEMBL18215143 0.97 AAK1 (0.44) AAK1CTSLCA1CA2CTSK
SCHEMBL6360143 0.92 DPP4 (0.43) AAK1CTSLCA1CA2CTSK
SCHEMBL6360147 0.92 DPP4 (0.43) AAK1CTSLCA1CA2CTSK
SCHEMBL6360141 0.92 DPP4 (0.43) AAK1CTSLCA1CA2CTSK
SCHEMBL6360139 0.92 DPP4 (0.43) AAK1CTSLCA1CA2CTSK
SCHEMBL12463556 0.91 EPHX1 (0.45) AAK1CTSLCA1CA2CTSK
SCHEMBL22501529 0.91 EPHX1 (0.45) AAK1CTSLCA1CA2CTSK

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-20130143858-A1 COMPOUNDS AND THEIR USE AS IKACH BLOCKERS ASTRAZENECA AB (SE) 2013-06-06 US disclosed
US-8361998-B2 Compounds and their use as IKACh blockers ASTRAZENECA AB 2013-01-29 US disclosed
WO-2012074469-A1 NEW IKACH BLOCKERS ASTRAZENECA AB (SE) 2012-06-07 WO disclosed
US-20120142659-A1 COMPOUNDS AND THEIR USE AS IKACH BLOCKERS ASTRAZENECA AB (SE) 2012-06-07 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 (2 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-20130143858-A1 COMPOUNDS AND THEIR USE AS IKACH BLOCKERS KCNH2, KCNJ2, KCNH3 AAK1 1591/4885CTSL 4188/4885CA1 1304/4885
US-20120142659-A1 COMPOUNDS AND THEIR USE AS IKACH BLOCKERS KCNH2, KCNJ2, KCNH3 AAK1 1591/4885CTSL 4188/4885CA1 1304/4885

“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.