SCHEMBL14464189

SCHEMBL14464189

O=[N+]([O-])c1ccc(N2CC2)c(F)c1

nearest known ligand 0.79

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.79
KMT2A Q03164 4/20 0.79
LMNA P02545 6/20 0.76
MAPT P10636 6/20 0.67
THRB P10828 1/20 0.67
POLB P06746 3/20 0.62
GAA P10253 3/20 0.57
DPP4 P27487 1/20 0.55
SLC6A5 Q9Y345 3/20 0.54
SLC6A9 P48067 2/20 0.53
MEN1 O00255 2/20 0.53
MAPK1 P28482 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.52
HPGD P15428 1/20 0.52

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
SCHEMBL4921368 0.93 ALDH1A1 (0.75) ALDH1A1KMT2ALMNAMAPTTHRB
SCHEMBL854050 0.92 ALDH1A1 (0.71) ALDH1A1KMT2ALMNAMAPTTHRB
SCHEMBL13455233 0.92 ALDH1A1 (0.69) ALDH1A1KMT2ALMNAMAPTTHRB
SCHEMBL30198175 0.92 ALDH1A1 (0.71) ALDH1A1KMT2ALMNAMAPTTHRB
SCHEMBL1127011 0.92 ALDH1A1 (0.73) ALDH1A1KMT2ALMNAMAPTTHRB
SCHEMBL30928952 0.92 ALDH1A1 (0.73) ALDH1A1KMT2ALMNAMAPTTHRB
SCHEMBL85672 0.92 ALDH1A1 (0.73) ALDH1A1KMT2ALMNAMAPTTHRB
SCHEMBL31342236 0.91 ALDH1A1 (0.68) ALDH1A1KMT2ALMNAMAPTTHRB
SCHEMBL5058298 0.90 ALDH1A1 (0.71) ALDH1A1KMT2ALMNAMAPTTHRB
SCHEMBL7814507 0.90 ALDH1A1 (0.66) ALDH1A1KMT2ALMNAMAPTTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8703939-B2 Method for preparing (R)-3-(3-fluoro-4-(1-methyl-5,6-dihydro-1,2,4-triazin-4(1H)-yl)phenyl)-5-(substituted methyl)oxazolidin-2-one derivatives LEGOCHEM BIOSCIENCES, INC. (KR) 2014-04-22 US disclosed
US-8703939-B2 Method for preparing (R)-3-(3-fluoro-4-(1-methyl-5,6-dihydro-1,2,4-triazin-4(1H)-yl)phenyl)-5-(substituted methyl)oxazolidin-2-one derivatives LEGOCHEM BIOSCIENCES, INC. (KR) 2014-04-22 US disclosed
US-20130005967-A1 METHOD FOR PREPARING (R)-3-(3-FLUORO-4-(1-METHYL-5,6-DIHYDRO-1,2,4-TRIAZIN-4(1H)-YL)PHENYL)-5-(SUBSTITUTED METHYL)OXAZOLIDIN-2-ONE DERIVATIVES LEGOCHEM BIOSCIENCES, INC. (KR) 2013-01-03 US disclosed
US-20130005967-A1 METHOD FOR PREPARING (R)-3-(3-FLUORO-4-(1-METHYL-5,6-DIHYDRO-1,2,4-TRIAZIN-4(1H)-YL)PHENYL)-5-(SUBSTITUTED METHYL)OXAZOLIDIN-2-ONE DERIVATIVES LEGOCHEM BIOSCIENCES, INC. (KR) 2013-01-03 US 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-20130005967-A1 METHOD FOR PREPARING (R)-3-(3-FLUORO-4-(1-METHYL-5,6-DIHYDRO-1,2,4-TRIAZIN-4(1H)-YL)PHENYL)-5-(SUBSTITUTED METHYL)OXAZOLIDIN-2-ONE DERIVATIVES TET1, AZI2, OXA1L ALDH1A1 1220/4885KMT2A 413/4885LMNA 3338/4885

“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.