SCHEMBL6097822

SCHEMBL6097822

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

nearest known ligand 0.72

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOA P21397 6/20 0.72
MAOB P27338 4/20 0.72
PTGS1 P23219 2/20 0.72
SDHA P31040 2/20 0.72
LMNA P02545 1/20 0.72
CALML3 P27482 1/20 0.72
F10 P00742 4/20 0.56

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
SCHEMBL12950996 1.00 MAOA (0.72) MAOAMAOBPTGS1SDHALMNA
SCHEMBL13034192 1.00 MAOA (0.72) MAOAMAOBPTGS1SDHALMNA
SCHEMBL16701350 0.92 MAOA (0.74) MAOAMAOBPTGS1SDHALMNA
SCHEMBL16701349 0.92 MAOA (0.74) MAOAMAOBPTGS1SDHALMNA
SCHEMBL3328441 0.91 MAOA (0.76) MAOAMAOBPTGS1SDHALMNA
SCHEMBL3328443 0.91 MAOA (0.76) MAOAMAOBPTGS1SDHALMNA
SCHEMBL3753257 0.90 MAOA (0.71) MAOAMAOBPTGS1SDHALMNA
SCHEMBL701373 0.90 MAOA (0.71) MAOAMAOBPTGS1SDHALMNA
SCHEMBL2088204 0.90 MAOA (0.71) MAOAMAOBPTGS1SDHALMNA
SCHEMBL3206976 0.90 MAOA (0.71) 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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170333400-A1 TOPICAL FORMULATIONS OF BIARYL HETEROCYCLIC COMPOUNDS AND METHODS OF USE THEREOF MELINTA SUBSIDIARY CORP. 2017-11-23 US disclosed
US-9376400-B2 Process for the synthesis of triazoles MELINTA THERAPEUTICS, INC. (US) 2016-06-28 US disclosed
US-20150158827-A1 Process for the Synthesis of Triazoles MELINTA SUBSIDIARY CORP. 2015-06-11 US disclosed
EP-1660465-B1 PROCESS FOR THE SYNTHESIS OF BIARYL OXAZOLIDINONES MELINTA THERAPEUTICS INC (US) 2014-12-17 EP disclosed
US-8895741-B2 Process for the synthesis of biaryl oxazolidinones MELINTA THERAPEUTICS, INC. (US) 2014-11-25 US disclosed
US-8796465-B2 Process for the syntheses of triazoles MELINTA THERAPEUTICS, INC. (US) 2014-08-05 US disclosed
US-20140031402-A1 Process for the Syntheses of Triazoles RIB-X PHARMACEUTICALS, INC. (US) 2014-01-30 US disclosed
US-20130066076-A1 Process for the Synthesis of Biaryl Oxazolidinones MELINTA SUBSIDIARY CORP. 2013-03-14 US disclosed
US-20090306389-A1 Intermediate products for producing oxazolidinone-quinolone hybrids MORPHOCHEM AKTIENGESELLSCHAFT FUR KOMBINATORISCHE CHEMIE (DE) 2009-12-10 US disclosed
US-7002020-B1 Oxazolidinone combinatorial libraries, compositions and methods of preparation PHARMACIA & UPJOHN COMPANY (US) 2006-02-21 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
EP-1200416-A1 OXAZOLIDINONES AND THEIR USE AS ANTIINFECTIVES Pharmacia & Upjohn Company (US) 2002-05-02 EP disclosed
US-6239152-B1 Oxazolidinone combinatorial libraries, compositions and methods of preparation PHARMACIA & UPJOHN COMPANY 2001-05-29 US disclosed
WO-2001009107-A1 OXAZOLIDINONES AND THEIR USE AS ANTIINFECTIVES PHARMACIA & UPJOHN COMPANY (US) 2001-02-08 WO 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 (7 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-20130066076-A1 Process for the Synthesis of Biaryl Oxazolidinones PCNA, PGC, SBDS MAOA 1272/4885MAOB 1133/4885PTGS1 203/4885
US-20090306389-A1 Intermediate products for producing oxazolidinone-quinolone hybrids OXA1L, NQO1, NQO2 MAOA 590/4885MAOB 391/4885PTGS1 1820/4885
US-20020183371-A1 Oxazolidinone combinatorial libraries, compositions and methods of preparation PAICS, CDK4, OXA1L MAOA 1267/4885MAOB 1298/4885PTGS1 4238/4885
US-20020169191-A1 Oxazolidinone compounds and methods of preparation and use thereof OXA1L, PAM, DPM1 MAOA 968/4885MAOB 852/4885PTGS1 2690/4885
US-20170333400-A1 TOPICAL FORMULATIONS OF BIARYL HETEROCYCLIC COMPOUNDS AND METHODS OF USE THEREOF CUTA, CYP19A1, KAT2A MAOA 379/4885MAOB 219/4885PTGS1 2113/4885
US-20140031402-A1 Process for the Syntheses of Triazoles PROKR1, VIP, SI MAOA 1794/4885MAOB 1380/4885PTGS1 49/4885
US-20150158827-A1 Process for the Synthesis of Triazoles PROKR1, SI, IL33 MAOA 1726/4885MAOB 1344/4885PTGS1 51/4885

“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.