SCHEMBL7107784

SCHEMBL7107784

CC(=O)NCC1CN(c2ccc(C3CCCS(=O)(=O)NC3)c(F)c2)C(=O)O1

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOA P21397 6/20 0.56
MAOB P27338 3/20 0.55
PTGS1 P23219 2/20 0.55
SDHA P31040 2/20 0.55
LMNA P02545 1/20 0.55
CALML3 P27482 1/20 0.55
F10 P00742 4/20 0.45

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
SCHEMBL7107786 1.00 MAOA (0.56) MAOAMAOBPTGS1SDHALMNA
SCHEMBL6040350 0.95 MAOA (0.57) MAOAMAOBPTGS1SDHALMNA
SCHEMBL6040357 0.88 MAOA (0.56) MAOAMAOBPTGS1SDHALMNA
SCHEMBL6040425 0.87 MAOA (0.49) MAOAMAOBPTGS1SDHALMNA
SCHEMBL5209849 0.85 MAOA (0.64) MAOAMAOBPTGS1SDHALMNA
SCHEMBL6396680 0.85 MAOA (0.65) MAOAMAOBPTGS1SDHALMNA
SCHEMBL6396676 0.85 MAOA (0.65) MAOAMAOBPTGS1SDHALMNA
SCHEMBL8307010 0.85 MAOA (0.59) MAOAMAOBPTGS1SDHALMNA
SCHEMBL8307008 0.85 MAOA (0.59) MAOAMAOBPTGS1SDHALMNA
SCHEMBL6398570 0.84 MAOA (0.60) MAOAMAOBPTGS1SDHALMNA

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-0717738-B1 SUBSTITUTED OXAZINE AND THIAZINE OXAZOLIDINONE ANTIMICROBIALS UPJOHN CO (US) 1999-10-20 EP claimed
US-20030171331-A1 The present invention describes a novel cotherapy of oxazolidinones and at least one vitamin selected from vitamin B2, vitamin B6, vitamin B12 and folic acid. PHARMACIA & UPJOHN COMPANY 2003-09-11 US disclosed
EP-0717738-B1 SUBSTITUTED OXAZINE AND THIAZINE OXAZOLIDINONE ANTIMICROBIALS UPJOHN CO (US) 1999-10-20 EP disclosed
EP-0717738-A1 SUBSTITUTED OXAZINE AND THIAZINE OXAZOLIDINONE ANTIMICROBIALS PHARMACIA & UPJOHN COMPANY (US) 1996-06-26 EP disclosed
WO-1995007271-A1 SUBSTITUTED OXAZINE AND THIAZINE OXAZOLIDINONE ANTIMICROBIALS THE UPJOHN COMPANY (US) 1995-03-16 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-20030171331-A1 The present invention describes a novel cotherapy of oxazolidinones and at least one vitamin selected from vitamin B2, vitamin B6, vitamin B12 and folic acid. DHFR, MMAB, FOLR2 MAOA 252/4885MAOB 13/4885PTGS1 2165/4885

“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.