SCHEMBL19990906

SCHEMBL19990906

CC(=O)O[C@@H]1C[C@H]2CN(Cc3ccccc3)C(=O)[C@H]2N(Cc2ccccc2)C1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CD274 Q9NZQ7 1/20 0.41
▸ CHRM2 P08172 1/20 0.39
▸ CHRM4 P08173 1/20 0.39
▸ CHRM5 P08912 1/20 0.39
▸ CHRM1 P11229 1/20 0.39
▸ CHRM3 P20309 1/20 0.39
▸ BRD4 O60885 3/20 0.39
▸ MTNR1A P48039 1/20 0.37
▸ MTNR1B P49286 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ BRS3 P32247 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ PREP P48147 1/20 0.36

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
SCHEMBL22368500 1.00 CD274 (0.41) CD274CHRM2CHRM4CHRM5CHRM1
SCHEMBL22368499 1.00 CD274 (0.41) CD274CHRM2CHRM4CHRM5CHRM1
SCHEMBL21981530 0.79 KDM4E (0.45) MAPTMEN1KMT2AALDH1A1
SCHEMBL19990744 0.79 KDM4E (0.45) MAPTMEN1KMT2AALDH1A1
SCHEMBL19990745 0.79 KDM4E (0.45) MAPTMEN1KMT2AALDH1A1
SCHEMBL22368471 0.79 KDM4E (0.45) MAPTMEN1KMT2AALDH1A1
SCHEMBL27495098 0.73 HPGD (0.54) BRD4MAPTKMT2AALDH1A1
SCHEMBL20012750 0.70 ALDH1A1 (0.44) MEN1KMT2AALDH1A1
SCHEMBL22368493 0.70 ALDH1A1 (0.44) MEN1KMT2AALDH1A1
SCHEMBL21088072 0.70 ALDH1A1 (0.44) MEN1KMT2AALDH1A1

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 9 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-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-10597396-B2 Beta-lactamase inhibitors NOVARTIS AG (CH) 2020-03-24 — — US disclosed
US-20190177324-A1 BETA-LACTAMASE INHIBITORS NOVARTIS AG (CH) 2019-06-13 — — US disclosed
US-20190177324-A1 BETA-LACTAMASE INHIBITORS NOVARTIS AG (CH) 2019-06-13 — — US disclosed
US-10065957-B2 Beta-lactamase inhibitors NOVARTIS AG (CH) 2018-09-04 — — 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 (4 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 CD274 2221/4885CHRM2 4081/4885CHRM4 4692/4885
US-10597396-B2 Beta-lactamase inhibitors MGAM, LCT, GAA CD274 2221/4885CHRM2 4081/4885CHRM4 4692/4885
US-20180086762-A1 BETA-LACTAMASE INHIBITORS MGAM, LCT, GAA CD274 2221/4885CHRM2 4081/4885CHRM4 4692/4885
US-10065957-B2 Beta-lactamase inhibitors MGAM, LCT, GAA CD274 2221/4885CHRM2 4081/4885CHRM4 4692/4885

“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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