SCHEMBL6793068

SCHEMBL6793068

CN(C)CC(=O)Nc1ccc(-c2ccc(N3CC(CCC(N)=O)OC3=O)cc2F)cn1

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CALML3 P27482 6/20 0.49
CYP2C19 P33261 2/20 0.49
CYP3A4 P08684 2/20 0.49
MAOA P21397 10/20 0.48
MAOB P27338 2/20 0.48
CYP2C9 P11712 1/20 0.46

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
SCHEMBL6612437 0.91 CALML3 (0.54) CALML3CYP2C19CYP3A4MAOAMAOB
SCHEMBL6791751 0.91 CALML3 (0.52) CALML3CYP2C19CYP3A4MAOAMAOB
Hydrochloric Acid SCHEMBL6799495 0.90 CALML3 (0.53) CALML3CYP2C19CYP3A4MAOAMAOB
SCHEMBL6791797 0.90 MAOA (0.53) CALML3CYP2C19CYP3A4MAOAMAOB
SCHEMBL6797224 0.90 MAOA (0.50) CALML3CYP2C19CYP3A4MAOAMAOB
SCHEMBL6796437 0.89 MAOA (0.51) CALML3CYP2C19CYP3A4MAOAMAOB
SCHEMBL6613813 0.88 CALML3 (0.54) CALML3CYP2C19CYP3A4MAOAMAOB
SCHEMBL6612203 0.88 CYP2C19 (0.49) CALML3CYP2C19CYP3A4MAOAMAOB
SCHEMBL6792251 0.87 CYP2C19 (0.53) CALML3CYP2C19CYP3A4MAOAMAOB
SCHEMBL6793065 0.86 MAOA (0.59) CALML3CYP2C19CYP3A4MAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6689779-B2 PYRIDINE OR PYRIMIDINE SUBSTITUTED; ANTIBACTERIAL ACTIVITY; LOW TOXICITY DONG A PHARM. CO., LTD. (KR) 2004-02-10 US claimed
US-20030166620-A1 Novel oxazolidinone derivatives and a process for the preparation thereof DONG A PHARM. CO., LTD. (KR) 2003-09-04 US claimed
US-6689779-B2 PYRIDINE OR PYRIMIDINE SUBSTITUTED; ANTIBACTERIAL ACTIVITY; LOW TOXICITY DONG A PHARM. CO., LTD. (KR) 2004-02-10 US disclosed
US-20030166620-A1 Novel oxazolidinone derivatives and a process for the preparation thereof DONG A PHARM. CO., LTD. (KR) 2003-09-04 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 (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-20030166620-A1 Novel oxazolidinone derivatives and a process for the preparation thereof OXA1L, ODC1, PDCD4 CALML3 4610/4885CYP2C19 39/4885CYP3A4 32/4885

“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.