SCHEMBL20528017

SCHEMBL20528017

CSc1ccc(-c2ccc(N3C[C@H](CNC(=O)O)OC3=O)cc2F)cc1

nearest known ligand 0.66

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAOA P21397 5/20 0.57
CALML3 P27482 7/20 0.57
MAOB P27338 4/20 0.52
LMNA P02545 1/20 0.52
PTGS1 P23219 1/20 0.52
SDHA P31040 1/20 0.52
F10 P00742 3/20 0.50
CYP3A4 P08684 1/20 0.49
CYP2C19 P33261 1/20 0.49

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
SCHEMBL20528026 1.00 MAOA (0.57) MAOACALML3MAOBLMNAPTGS1
SCHEMBL18770298 1.00 MAOA (0.57) MAOACALML3MAOBLMNAPTGS1
SCHEMBL18786526 0.91 CALML3 (0.55) MAOACALML3MAOBLMNAPTGS1
SCHEMBL18786527 0.91 CALML3 (0.55) MAOACALML3MAOBLMNAPTGS1
SCHEMBL18786423 0.91 CALML3 (0.55) MAOACALML3MAOBLMNAPTGS1
SCHEMBL18770300 0.91 CALML3 (0.55) MAOACALML3MAOBLMNAPTGS1
SCHEMBL18787219 0.90 MAOA (0.53) MAOACALML3MAOBLMNAPTGS1
SCHEMBL18786547 0.90 MAOA (0.53) MAOACALML3MAOBLMNAPTGS1
SCHEMBL18770253 0.90 MAOB (0.61) MAOACALML3MAOBLMNAPTGS1
SCHEMBL18786436 0.90 MAOB (0.61) MAOACALML3MAOBLMNAPTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-20180290987-A1 OXAZOLIDINONE COMPOUNDS AND METHODS OF USE THEREOF AS ANTIBACTERIAL AGENTS MERCK SHARP & DOHME CORP. 2018-10-11 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 (3 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 MAOA 1773/4885CALML3 3904/4885MAOB 951/4885
US-20180290987-A1 OXAZOLIDINONE COMPOUNDS AND METHODS OF USE THEREOF AS ANTIBACTERIAL AGENTS OXA1L, ERAL1, TBCD MAOA 1773/4885CALML3 3904/4885MAOB 951/4885
US-20210061777-A1 OXAZOLIDINONE COMPOUNDS AND METHODS OF USE THEREOF AS ANTIBACTERIAL AGENTS OXA1L, ERAL1, TBCD MAOA 1773/4885CALML3 3904/4885MAOB 951/4885

“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.