SCHEMBL18786451

SCHEMBL18786451

CSc1ccc(-c2ccc(N3CC(Cn4ccnc4)OC3=O)cc2F)cc1

nearest known ligand 0.57

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CALML3 P27482 5/20 0.57
CYP3A4 P08684 3/20 0.57
CYP2C9 P11712 1/20 0.57
CYP2D6 P10635 1/20 0.52
MAOA P21397 11/20 0.52

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
SCHEMBL20528027 1.00 CALML3 (0.57) CALML3CYP3A4CYP2C9CYP2D6MAOA
SCHEMBL18786544 1.00 CALML3 (0.57) CALML3CYP3A4CYP2C9CYP2D6MAOA
SCHEMBL18790187 0.91 CALML3 (0.55) CALML3CYP3A4CYP2C9CYP2D6MAOA
SCHEMBL5233140 0.87 CYP3A4 (0.42) CALML3CYP3A4CYP2C9
SCHEMBL18770261 0.84 CALML3 (0.55) CALML3CYP3A4CYP2C9CYP2D6MAOA
SCHEMBL18786545 0.84 CYP3A4 (0.56) CALML3CYP3A4CYP2D6MAOA
SCHEMBL18786431 0.84 CALML3 (0.55) CALML3CYP3A4CYP2C9CYP2D6MAOA
SCHEMBL18786438 0.84 CYP3A4 (0.56) CALML3CYP3A4CYP2D6MAOA
SCHEMBL20528013 0.83 CALML3 (0.74) CALML3CYP3A4CYP2C9CYP2D6MAOA
SCHEMBL29432578 0.83 CALML3 (0.74) CALML3CYP3A4CYP2C9CYP2D6MAOA

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-20210061777-A1 OXAZOLIDINONE COMPOUNDS AND METHODS OF USE THEREOF AS ANTIBACTERIAL AGENTS MERCK SHARP & DOHME CORP. (US) 2021-03-04 US 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

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-20210061777-A1 OXAZOLIDINONE COMPOUNDS AND METHODS OF USE THEREOF AS ANTIBACTERIAL AGENTS OXA1L, ERAL1, TBCD CALML3 3904/4885CYP3A4 1996/4885CYP2C9 1304/4885

“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.