SCHEMBL2763844

SCHEMBL2763844

COC(=O)[C@H](COC(C)(C)C)N[SiH](C)C

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 1/20 0.36
▸ GRN P28799 1/20 0.36
▸ SORT1 Q99523 1/20 0.36
▸ BACE1 P56817 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.31
▸ CA1 P00915 1/20 0.31
▸ CA2 P00918 1/20 0.31
▸ LIPG Q9Y5X9 1/20 0.30
▸ KEAP1 Q14145 1/20 0.30
▸ MEN1 O00255 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ KMT2A Q03164 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
SCHEMBL27584232 0.84 GRN (0.47) MAPK1GRNSORT1BACE1KEAP1
SCHEMBL28528204 0.81 MAPK1 (0.41) MAPK1GRNSORT1BACE1KDM4E
SCHEMBL1361481 0.81 MAPK1 (0.41) MAPK1GRNSORT1BACE1KDM4E
SCHEMBL14211341 0.78 GRN (0.44) MAPK1GRNSORT1BACE1KDM4E
SCHEMBL14533530 0.78 GRN (0.44) MAPK1GRNSORT1BACE1KDM4E
SCHEMBL16508862 0.75 MAPK1 (0.48) MAPK1GRNSORT1BACE1CA1
SCHEMBL12171679 0.75 MAPK1 (0.48) MAPK1GRNSORT1BACE1CA1
SCHEMBL23805193 0.74 CTSK (0.46) CA1CA2
SCHEMBL2158515 0.74 CTSK (0.46) CA1CA2
SCHEMBL8372342 0.74 CTSK (0.46) CA1CA2

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
EP-1400515-B1 CYCLIC DIAMINE COMPOUND HAVING FIVE-MEMBERED CYCLIC GROUP KOWA CO (JP) 2010-04-14 — — EP disclosed
US-20090047244-A1 MACROCYCLIC SERINE PROTEASE INHIBITORS I IDENIX PHARMACEUTICALS, INC. (US) 2009-02-19 — — US disclosed
EP-1400515-A1 CYCLIC DIAMINE COMPOUND HAVING FIVE-MEMBERED CYCLIC GROUP Kowa Co., Ltd. (JP) 2004-03-24 — — EP disclosed
US-6472386-B1 Cyclic diamine compound with 5-membered ring groups KOWA CO., LTD. (JP) 2002-10-29 — — 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-20090047244-A1 MACROCYCLIC SERINE PROTEASE INHIBITORS I SERPINB1, SPINT2, PRSS1 MAPK1 2565/4885GRN 1136/4885SORT1 1885/4885

“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.

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