SCHEMBL1854963

SCHEMBL1854963

O=[N+]([O-])c1cc(F)c(N2CCC(O)C2)c(F)c1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.41
MAPT P10636 8/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
LMNA P02545 4/20 0.41
KDM4E B2RXH2 1/20 0.39
NPY2R P49146 1/20 0.37
TDP1 Q9NUW8 2/20 0.36
MAPK1 P28482 1/20 0.36
POLB P06746 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
HTT P42858 1/20 0.36
THRB P10828 1/20 0.36
TOP1 P11387 1/20 0.36
TOP2A P11388 1/20 0.36

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
SCHEMBL4703887 0.88 ALDH1A1 (0.40) ALDH1A1MAPTKMT2AMEN1LMNA
SCHEMBL12547367 0.82 ALDH1A1 (0.49) ALDH1A1MAPTKMT2AMEN1LMNA
SCHEMBL854197 0.82 ALDH1A1 (0.59) ALDH1A1MAPTKMT2AMEN1LMNA
SCHEMBL7805532 0.82 ALDH1A1 (0.59) ALDH1A1MAPTKMT2AMEN1LMNA
SCHEMBL17512618 0.80 ALDH1A1 (0.48) ALDH1A1MAPTKMT2AMEN1LMNA
SCHEMBL17512452 0.80 ALDH1A1 (0.48) ALDH1A1MAPTKMT2AMEN1LMNA
SCHEMBL17512453 0.80 ALDH1A1 (0.48) ALDH1A1MAPTKMT2AMEN1LMNA
SCHEMBL6478813 0.79 ALDH1A1 (0.38) ALDH1A1MAPTKMT2AMEN1LMNA
SCHEMBL29179883 0.78 ALDH1A1 (0.39) ALDH1A1MAPTKMT2ALMNANPY2R
SCHEMBL1856887 0.78 ALDH1A1 (0.42) ALDH1A1MAPTKMT2ALMNATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2324016-B1 3-(N-HETEROCYCLYL)-PYRROLIDINYL-PHENYL-OXAZOLIDINONES AS ANTIBACTERIAL AGENTS FERRER INT (ES) 2012-04-25 EP disclosed
EP-2324016-B1 3-(N-HETEROCYCLYL)-PYRROLIDINYL-PHENYL-OXAZOLIDINONES AS ANTIBACTERIAL AGENTS FERRER INT (ES) 2012-04-25 EP disclosed
US-20110136829-A1 3-(N-HETEROCYCLYL)-PYRROLIDINYL-PHENYL-OXAZOLIDINONES AS ANTIBACTERIAL AGENTS FERRER INTERNACIONAL, S.A. (ES) 2011-06-09 US disclosed
US-20110136829-A1 3-(N-HETEROCYCLYL)-PYRROLIDINYL-PHENYL-OXAZOLIDINONES AS ANTIBACTERIAL AGENTS FERRER INTERNACIONAL, S.A. (ES) 2011-06-09 US disclosed
US-20110136829-A1 3-(N-HETEROCYCLYL)-PYRROLIDINYL-PHENYL-OXAZOLIDINONES AS ANTIBACTERIAL AGENTS FERRER INTERNACIONAL, S.A. (ES) 2011-06-09 US disclosed
EP-2324016-A1 3-(N-HETEROCYCLYL)-PYRROLIDINYL-PHENYL-OXAZOLIDINONES AS ANTIBACTERIAL AGENTS Ferrer Internacional, S.A. (ES) 2011-05-25 EP disclosed
WO-2010000704-A1 3-(N-HETEROCYCLYL)-PYRROLIDINYL-PHENYL-OXAZOLIDINONES AS ANTIBACTERIAL AGENTS FERRER INTERNACIONAL, S.A. (ES) 2010-01-07 WO disclosed
WO-2010000704-A1 3-(N-HETEROCYCLYL)-PYRROLIDINYL-PHENYL-OXAZOLIDINONES AS ANTIBACTERIAL AGENTS FERRER INTERNACIONAL, S.A. (ES) 2010-01-07 WO disclosed
EP-2141162-A1 3-(n-heterocyclyl)-pyrrolidinyl-phenyl-oxazolidinones as antibacterial agents Ferrer Internacional, S.A. (ES) 2010-01-06 EP disclosed
EP-2141162-A1 3-(n-heterocyclyl)-pyrrolidinyl-phenyl-oxazolidinones as antibacterial agents Ferrer Internacional, S.A. (ES) 2010-01-06 EP 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-20110136829-A1 3-(N-HETEROCYCLYL)-PYRROLIDINYL-PHENYL-OXAZOLIDINONES AS ANTIBACTERIAL AGENTS OXA1L, MRPL21, RPL5 ALDH1A1 1275/4885MAPT 4653/4885KMT2A 4690/4885

“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.