SCHEMBL463725

SCHEMBL463725

COC(=O)NC[C@H]1CN(c2ccc(-c3ccc(N4CCOC4=O)nc3)c(F)c2)C(=O)O1

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAOA P21397 10/20 0.50
CALML3 P27482 5/20 0.49
MAOB P27338 4/20 0.49
CYP2C19 P33261 2/20 0.49
CYP3A4 P08684 1/20 0.49
LMNA P02545 1/20 0.49
PTGS1 P23219 1/20 0.49
SDHA P31040 1/20 0.49
CYP2C9 P11712 1/20 0.48
F10 P00742 1/20 0.47

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
SCHEMBL442982 0.92 MAOA (0.60) MAOACALML3MAOBCYP2C19CYP3A4
SCHEMBL12964761 0.89 MAOA (0.49) MAOACALML3MAOBCYP2C19CYP3A4
SCHEMBL463740 0.89 CALML3 (0.51) MAOACALML3MAOBCYP2C19CYP3A4
SCHEMBL4168447 0.88 MAOA (0.53) MAOACALML3MAOBCYP2C19CYP3A4
SCHEMBL4168449 0.88 MAOA (0.53) MAOACALML3MAOBCYP2C19CYP3A4
SCHEMBL463557 0.88 MAOA (0.49) MAOACALML3MAOBCYP2C19CYP3A4
SCHEMBL463591 0.88 MAOA (0.49) MAOACALML3MAOBCYP2C19CYP3A4
SCHEMBL463272 0.88 F10 (0.53) MAOACALML3MAOBCYP2C19CYP3A4
SCHEMBL4168134 0.87 MAOA (0.58) MAOACALML3MAOBCYP2C19CYP3A4
SCHEMBL4168138 0.87 MAOA (0.58) MAOACALML3MAOBCYP2C19CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120065170-A1 Antimicrobial Cyclocarbonyl Heterocyclic Compounds For Treatment Of Bacterial Infections MICURX PHARMACEUTICALS, INC. (KY) 2012-03-15 US disclosed
WO-2012033952-A1 3 - PHENYL- 2 -OXO- 1, 3 -OXAZOLIDINES FOR TREATMENT OF BACTERIAL INFECTIONS MICURX PHARMACEUTICALS, INC. (KY) 2012-03-15 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-20120065170-A1 Antimicrobial Cyclocarbonyl Heterocyclic Compounds For Treatment Of Bacterial Infections NISCH, SI, VIP MAOA 853/4885CALML3 1652/4885MAOB 427/4885

“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.