SCHEMBL6093515

SCHEMBL6093515

NC[C@H]1CN(c2ccc(-c3ccc(C(N)=O)cc3)c(F)c2)C(=O)O1

nearest known ligand 0.63

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CALML3 P27482 6/20 0.63
▸ MAOA P21397 7/20 0.53
▸ MAOB P27338 2/20 0.53
▸ CYP2C19 P33261 2/20 0.50
▸ CYP2C9 P11712 1/20 0.50
▸ CYP3A4 P08684 2/20 0.49
▸ CYP2D6 P10635 1/20 0.48

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
SCHEMBL18786530 1.00 CALML3 (0.63) CALML3MAOAMAOBCYP2C19CYP2C9
SCHEMBL18790181 0.93 CALML3 (0.62) CALML3MAOAMAOBCYP2C19CYP2C9
SCHEMBL18786549 0.89 CALML3 (0.62) CALML3MAOAMAOBCYP2C19CYP2C9
SCHEMBL18786210 0.89 CALML3 (0.62) CALML3MAOAMAOBCYP2C19CYP2C9
SCHEMBL18786214 0.88 CALML3 (0.69) CALML3MAOAMAOBCYP2C19CYP2C9
SCHEMBL18786552 0.88 CALML3 (0.69) CALML3MAOAMAOBCYP2C19CYP2C9
SCHEMBL6092806 0.88 CALML3 (0.59) CALML3MAOAMAOBCYP2C19CYP2C9
SCHEMBL6092804 0.88 CALML3 (0.59) CALML3MAOAMAOBCYP2C19CYP2C9
SCHEMBL18770280 0.87 CALML3 (0.56) CALML3MAOAMAOBCYP2C19CYP3A4
SCHEMBL18790221 0.87 CALML3 (0.56) CALML3MAOAMAOBCYP2C19CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108135887-B Oxazolidinone compounds and methods of use as antibacterial agents 默沙东公司 2021-07-30 — — CN disclosed
US-10947205-B2 Oxazolidinone compounds and methods of use thereof as antibacterial agents MERCK SHARP & DOHME CORP. (US) 2021-03-16 — — US disclosed
US-10947205-B2 Oxazolidinone compounds and methods of use thereof as antibacterial agents MERCK SHARP & DOHME CORP. (US) 2021-03-16 — — US disclosed
US-20210061777-A1 OXAZOLIDINONE COMPOUNDS AND METHODS OF USE THEREOF AS ANTIBACTERIAL AGENTS MERCK SHARP & DOHME CORP. (US) 2021-03-04 — — US disclosed
US-20210061777-A1 OXAZOLIDINONE COMPOUNDS AND METHODS OF USE THEREOF AS ANTIBACTERIAL AGENTS MERCK SHARP & DOHME CORP. (US) 2021-03-04 — — US disclosed
US-20190248753-A1 OXAZOLIDINONE COMPOUNDS AND METHODS OF USE THEREOF AS ANTIBACTERIAL AGENTS MERCK SHARP & DOHME LLC 2019-08-15 — — US disclosed
US-20190248753-A1 OXAZOLIDINONE COMPOUNDS AND METHODS OF USE THEREOF AS ANTIBACTERIAL AGENTS MERCK SHARP & DOHME LLC 2019-08-15 — — US disclosed
US-20180290987-A1 OXAZOLIDINONE COMPOUNDS AND METHODS OF USE THEREOF AS ANTIBACTERIAL AGENTS MERCK SHARP & DOHME CORP. 2018-10-11 — — US disclosed
EP-3364968-A1 OXAZOLIDINONE COMPOUNDS AND METHODS OF USE THEREOF AS ANTIBACTERIAL AGENTS Merck Sharp & Dohme Corp. (US) 2018-08-29 — — EP disclosed
WO-2017070024-A1 OXAZOLIDINONE COMPOUNDS AND METHODS OF USE THEREOF AS ANTIBACTERIAL AGENTS MERCK SHARP & DOHME CORP. (US) 2017-04-27 — — WO disclosed
WO-2017066964-A1 OXAZOLIDINONE COMPOUNDS AND METHODS OF USE THEREOF AS ANTIBACTERIAL AGENTS MERCK SHARP & DOHME CORP. (US) 2017-04-27 — — WO disclosed
WO-2017070024-A1 OXAZOLIDINONE COMPOUNDS AND METHODS OF USE THEREOF AS ANTIBACTERIAL AGENTS MERCK SHARP & DOHME CORP. (US) 2017-04-27 — — WO disclosed
US-20060270680-A1 Sulfonamide compounds and methods of making and using the same RIB-X PHARMACEUTICALS, INC. 2006-11-30 — — 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 (5 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-10947205-B2 Oxazolidinone compounds and methods of use thereof as antibacterial agents OXA1L, ERAL1, TBCD CALML3 3904/4885MAOA 1773/4885MAOB 951/4885
US-20190248753-A1 OXAZOLIDINONE COMPOUNDS AND METHODS OF USE THEREOF AS ANTIBACTERIAL AGENTS OXA1L, ERAL1, TBCD CALML3 3904/4885MAOA 1773/4885MAOB 951/4885
US-20180290987-A1 OXAZOLIDINONE COMPOUNDS AND METHODS OF USE THEREOF AS ANTIBACTERIAL AGENTS OXA1L, ERAL1, TBCD CALML3 3904/4885MAOA 1773/4885MAOB 951/4885
US-20210061777-A1 OXAZOLIDINONE COMPOUNDS AND METHODS OF USE THEREOF AS ANTIBACTERIAL AGENTS OXA1L, ERAL1, TBCD CALML3 3904/4885MAOA 1773/4885MAOB 951/4885
US-20060270680-A1 Sulfonamide compounds and methods of making and using the same PCNA, SI, SQOR CALML3 3744/4885MAOA 2626/4885MAOB 3309/4885

“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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