SCHEMBL20009195

SCHEMBL20009195

CC(C)(C)OC(=O)N1C[C@H](N(OCc2ccccc2)C(=O)OC(C)(C)C)C[C@H]2CCN(c3cccc4cccnc34)C(=O)[C@H]21

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 4/20 0.39
JAK2 O60674 1/20 0.39
JAK1 P23458 1/20 0.39
PKLR P30613 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.37
HTT P42858 2/20 0.37
POLB P06746 2/20 0.37
GAA P10253 1/20 0.37
TSHR P16473 1/20 0.37
KDM4E B2RXH2 1/20 0.37
MAPT P10636 3/20 0.36
ALDH1A1 P00352 3/20 0.36
LMNA P02545 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
TP53 P04637 1/20 0.35

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
SCHEMBL19990936 0.96 PKLR (0.38) MAPK1JAK2JAK1PKLRSMN1; SMN2
SCHEMBL20009196 0.77 JAK2 (0.42) JAK2JAK1L3MBTL1
SCHEMBL20009190 0.75 POLB (0.43) MAPK1POLBGAATSHRKDM4E
SCHEMBL20009193 0.74 UBE2M (0.38) MAPK1PKLRPOLBGAATSHR
SCHEMBL20009191 0.73 UBE2M (0.37) MAPK1PKLRPOLBGAATSHR
SCHEMBL19990672 0.72 JAK2 (0.39) JAK2JAK1L3MBTL1
SCHEMBL19990855 0.72 UBE2M (0.42) PKLRPOLBGAATSHRKDM4E
SCHEMBL20009194 0.71 UBE2M (0.37) MAPK1PKLRPOLBGAATSHR
SCHEMBL17956429 0.71 PKLR (0.35) MAPK1JAK2JAK1PKLRSMN1; SMN2
SCHEMBL19990942 0.70 UBE2M (0.40) PKLRPOLBGAATSHRLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3698796-B1 PHARMACEUTICAL COMBINATION OF A TRICYCLIC BETA-LACTAMASE INHIBITOR WITH SPECIFIC BETA-LACTAM ANTIBIOTICS NOVARTIS AG (CH) 2021-10-27 EP disclosed
EP-3698796-A1 PHARMACEUTICAL COMBINATION OF A TRICYCLIC BETA-LACTAMASE INHIBITOR WITH SPECIFIC BETA-LACTAM ANTIBIOTICS Novartis AG (CH) 2020-08-26 EP disclosed
US-20190177324-A1 BETA-LACTAMASE INHIBITORS NOVARTIS AG (CH) 2019-06-13 US disclosed
US-20180086762-A1 BETA-LACTAMASE INHIBITORS NOVARTIS AG (CH) 2018-03-29 US disclosed
US-20180086762-A1 BETA-LACTAMASE INHIBITORS NOVARTIS AG (CH) 2018-03-29 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 (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-20190177324-A1 BETA-LACTAMASE INHIBITORS MGAM, LCT, GAA MAPK1 3985/4885JAK2 4750/4885JAK1 4824/4885
US-20180086762-A1 BETA-LACTAMASE INHIBITORS MGAM, LCT, GAA MAPK1 3985/4885JAK2 4750/4885JAK1 4824/4885

“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.