SCHEMBL6612909

SCHEMBL6612909

NC(=O)CCC1CN(c2ccc(-c3ccc(NC(=O)c4cccnc4)nc3)c(F)c2)C(=O)O1

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CALML3 P27482 6/20 0.51
▸ CYP3A4 P08684 3/20 0.51
▸ CYP2D6 P10635 1/20 0.51
▸ MAOA P21397 7/20 0.46
▸ MAOB P27338 1/20 0.46
▸ CYP2C9 P11712 2/20 0.45
▸ CYP2C19 P33261 2/20 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
SCHEMBL6612901 0.87 MAOA (0.55) CALML3CYP3A4CYP2D6MAOAMAOB
SCHEMBL17040284 0.87 MAOA (0.55) CALML3CYP3A4CYP2D6MAOAMAOB
SCHEMBL6791797 0.86 MAOA (0.53) CALML3CYP3A4MAOAMAOBCYP2C9
SCHEMBL6612437 0.85 CALML3 (0.54) CALML3CYP3A4MAOAMAOBCYP2C9
SCHEMBL6791751 0.85 CALML3 (0.52) CALML3CYP3A4MAOAMAOBCYP2C9
SCHEMBL27573543 0.85 CYP3A4 (0.45) CALML3CYP3A4CYP2D6MAOAMAOB
Hydrochloric Acid SCHEMBL6799495 0.84 CALML3 (0.53) CALML3CYP3A4MAOAMAOBCYP2C9
SCHEMBL6613813 0.84 CALML3 (0.54) CALML3CYP3A4MAOAMAOBCYP2C9
SCHEMBL6674285 0.83 CYP3A4 (0.49) CALML3CYP3A4CYP2D6MAOAMAOB
SCHEMBL6792251 0.83 CYP2C19 (0.53) CALML3CYP3A4MAOAMAOBCYP2C9

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 7 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
EP-1289984-A4 NOVEL OXAZOLIDINONE DERIVATIVES AND A PROCESS FOR THE PREPARATION THEREOF DONG A PHARM CO LTD (KR) 2004-11-24 — — EP disclosed
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
EP-1289984-A1 NOVEL OXAZOLIDINONE DERIVATIVES AND A PROCESS FOR THE PREPARATION THEREOF Dong A Pharmaceutical Co. Ltd. (KR) 2003-03-12 — — EP disclosed
WO-2001094342-A1 NOVEL OXAZOLIDINONE DERIVATIVES AND A PROCESS FOR THE PREPARATION THEREOF DONG A PHARM. CO., LTD. (KR) 2001-12-13 — — 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-20030166620-A1 Novel oxazolidinone derivatives and a process for the preparation thereof OXA1L, ODC1, PDCD4 CALML3 4610/4885CYP3A4 32/4885CYP2D6 44/4885

“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.

Send feedback