SCHEMBL2589030

SCHEMBL2589030

Cc1cc(NC[C@H](O)CN2C(=O)c3ccccc3C2=O)cc(C)c1-n1cccc(CCO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)c1=O

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.40
MAPT P10636 1/20 0.40
KMT2A Q03164 2/20 0.34
MAPK1 P28482 1/20 0.33
SMYD2 Q9NRG4 1/20 0.30
RAB9A P51151 1/20 0.30

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
SCHEMBL2589033 1.00 ALDH1A1 (0.40) ALDH1A1MAPTKMT2AMAPK1SMYD2
SCHEMBL2474781 0.78 SMYD2 (0.34) SMYD2
SCHEMBL3418237 0.77 F2 (0.36) SMYD2
SCHEMBL2474091 0.76 SMYD2 (0.34) ALDH1A1MAPTKMT2AMAPK1SMYD2
SCHEMBL16919012 0.72 SMYD2 (0.32) SMYD2
SCHEMBL2475744 0.71 SMYD2 (0.34) ALDH1A1MAPTKMT2ASMYD2RAB9A
SCHEMBL3422147 0.70 F10 (0.38)
SCHEMBL28994474 0.69 RAB9A (0.36) ALDH1A1MAPTKMT2ASMYD2RAB9A
SCHEMBL2473621 0.69 NPC1 (0.35) ALDH1A1MAPTKMT2AMAPK1SMYD2
SCHEMBL18222530 0.67 SMYD2 (0.40) ALDH1A1MAPTKMT2AMAPK1SMYD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8846934-B2 Substituted oxazolidinones and their use BAYER INTELLECTUAL PROPERTY GMBH (DE) 2014-09-30 US disclosed
US-20140057951-A1 SUBSTITUTED OXAZOLIDINONES AND THEIR USE BAYER INTELLECTUAL PROPERTY GMBH (DE) 2014-02-27 US disclosed
EP-2563762-A1 METHOD FOR PRODUCING SUBSTITUTED PYRIDIN-2-ONE Bayer Intellectual Property GmbH (DE) 2013-03-06 EP disclosed
US-8383822-B2 Substituted oxazolidinones and their use BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-02-26 US disclosed
WO-2011134963-A1 METHOD FOR PRODUCING SUBSTITUTED PYRIDIN-2-ONE BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2011-11-03 WO disclosed
US-20100184740-A1 SUBSTITUTED OXAZOLIDINONES AND THEIR USE BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-07-22 US disclosed
EP-2170877-A1 SUBSTITUTED (OXAZOLIDINON-5-YL-METHYL) -2-THIOPHENE-CARBOXAMIDES AND USE THEREOF IN THE FIELD OF BLOOD COAGULATION Bayer HealthCare AG (DE) 2010-04-07 EP disclosed
WO-2008155032-A1 SUBSTITUTED (OXAZOLIDINON-5-YL-METHYL) -2-THIOPHENE-CARBOXAMIDES AND USE THEREOF IN THE FIELD OF BLOOD COAGULATION BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-12-24 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 (2 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-20140057951-A1 SUBSTITUTED OXAZOLIDINONES AND THEIR USE XDH, MPL, OXA1L ALDH1A1 523/4885MAPT 4772/4885KMT2A 3284/4885
US-20100184740-A1 SUBSTITUTED OXAZOLIDINONES AND THEIR USE XDH, MPL, OXA1L ALDH1A1 523/4885MAPT 4772/4885KMT2A 3284/4885

“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.