SCHEMBL6098702

SCHEMBL6098702

NC[C@H]1CN(c2ccc(SC(c3ccccc3)(c3ccccc3)c3ccccc3)c(F)c2)C(=O)O1

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 2/20 0.43
▸ GRM2 Q14416 6/20 0.43
▸ CALML3 P27482 6/20 0.43
▸ MAOA P21397 1/20 0.39
▸ MAOB P27338 1/20 0.39

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
SCHEMBL6096829 0.90 CALML3 (0.54) GRM2CALML3MAOAMAOB
SCHEMBL6916830 0.88 MAOB (0.43) F10GRM2CALML3MAOAMAOB
SCHEMBL6098705 0.82 F10 (0.46) F10GRM2CALML3
SCHEMBL16701334 0.78 BPTF (0.57) F10GRM2CALML3MAOAMAOB
SCHEMBL16701336 0.78 BPTF (0.57) F10GRM2CALML3MAOAMAOB
SCHEMBL18786420 0.78 CALML3 (0.65) F10CALML3MAOAMAOB
SCHEMBL18786447 0.78 CALML3 (0.65) F10CALML3MAOAMAOB
SCHEMBL12157633 0.77 F10 (0.57) F10GRM2CALML3MAOAMAOB
SCHEMBL592028 0.76 F10 (0.53) F10GRM2CALML3MAOAMAOB
SCHEMBL592027 0.76 F10 (0.53) F10GRM2CALML3MAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7002020-B1 Oxazolidinone combinatorial libraries, compositions and methods of preparation PHARMACIA & UPJOHN COMPANY (US) 2006-02-21 — — US disclosed
US-20050004174-A1 Antibacterial agents GORDEEV MIKHAIL F (US) 2005-01-06 — — US disclosed
US-6743811-B2 MICROBIOCIDES PHARMACIA & UPJOHN COMPANY 2004-06-01 — — US disclosed
US-6562844-B2 Attaching an olefin to a solid support; oxidizing the olefin to provide an epoxide functionality; opening the epoxide with an amine to form an amino alcohol; cyclizing the amino alcohol using a phosgene equivalent PHARMACIA & UPJOHN COMPANY 2003-05-13 — — US disclosed
US-6531470-B1 Antimicrobial compounds PHARMACIA & UPJOHN COMPANY 2003-03-11 — — US disclosed
US-20020183371-A1 Oxazolidinone combinatorial libraries, compositions and methods of preparation GORDEEV MIKHAIL F (US) 2002-12-05 — — US disclosed
US-20020169191-A1 Oxazolidinone compounds and methods of preparation and use thereof PHARMACIA & UPJOHN COMPANY (US) 2002-11-14 — — US disclosed
US-6441005-B1 BACTERICIDES, ANTIBIOTICS AND MICROBIOCIDES PHARMACIA & UPJOHN COMPANY 2002-08-27 — — US disclosed
US-6239152-B1 Oxazolidinone combinatorial libraries, compositions and methods of preparation PHARMACIA & UPJOHN COMPANY 2001-05-29 — — US disclosed
EP-1049682-A1 OXAZOLIDINONE COMBINATORIAL LIBRARIES, COMPOSITIONS AND METHODS OF PREPARATION Versicor, Inc. (US) 2000-11-08 — — EP disclosed
WO-1999037630-A1 OXAZOLIDINONE COMBINATORIAL LIBRARIES, COMPOSITIONS AND METHODS OF PREPARATION VERSICOR, INC. (US) 1999-07-29 — — 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 (3 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-20020183371-A1 Oxazolidinone combinatorial libraries, compositions and methods of preparation PAICS, CDK4, OXA1L F10 2271/4885GRM2 2144/4885CALML3 3555/4885
US-20020169191-A1 Oxazolidinone compounds and methods of preparation and use thereof OXA1L, PAM, DPM1 F10 3952/4885GRM2 2370/4885CALML3 3603/4885
US-20050004174-A1 Antibacterial agents PAICS, OXA1L, PNKP F10 3302/4885GRM2 3354/4885CALML3 3997/4885

“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.

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