SCHEMBL3419892

SCHEMBL3419892

C/C=C\c1cc([N+](=O)[O-])ccc1-n1cccc(OC)c1=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.43
ALDH1A1 P00352 5/20 0.43
LMNA P02545 5/20 0.43
MAPK1 P28482 3/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
TDP1 Q9NUW8 3/20 0.41
NTSR1 P30989 1/20 0.40
HTT P42858 2/20 0.40
PTGS2 P35354 2/20 0.39
CYP19A1 P11511 1/20 0.39
TLR9 Q9NR96 1/20 0.38
MEN1 O00255 1/20 0.38
CRHBP P24387 1/20 0.38
KMT2A Q03164 1/20 0.38
CRHR2 Q13324 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
RECQL P46063 1/20 0.37
DUSP3 P51452 1/20 0.37
PTPN5 P54829 1/20 0.37
PTPN11 Q06124 1/20 0.37

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
SCHEMBL3419897 1.00 MAPT (0.43) MAPTALDH1A1LMNAMAPK1SMN1; SMN2
SCHEMBL13272460 1.00 MAPT (0.43) MAPTALDH1A1LMNAMAPK1SMN1; SMN2
SCHEMBL3419912 0.84 F2RL3 (0.36) MAPTALDH1A1LMNAMAPK1SMN1; SMN2
SCHEMBL13272130 0.84 F2RL3 (0.36) MAPTALDH1A1LMNAMAPK1SMN1; SMN2
SCHEMBL3419910 0.84 F2RL3 (0.36) MAPTALDH1A1LMNAMAPK1SMN1; SMN2
SCHEMBL3060321 0.84 CHEK1 (0.38) MAPTALDH1A1LMNAMEN1KMT2A
SCHEMBL3422710 0.84 ERN1 (0.42) MAPTALDH1A1LMNAMAPK1SMN1; SMN2
SCHEMBL13272461 0.84 ERN1 (0.42) MAPTALDH1A1LMNAMAPK1SMN1; SMN2
SCHEMBL2477838 0.84 CHEK1 (0.38) MAPTALDH1A1LMNAMEN1KMT2A
SCHEMBL3422707 0.84 ERN1 (0.42) MAPTALDH1A1LMNAMAPK1SMN1; SMN2

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 5 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
US-8383822-B2 Substituted oxazolidinones and their use BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-02-26 US disclosed
EP-2170877-B1 SUBSTITUTED (OXAZOLIDINON-5-YL-METHYL) -2-THIOPHENE-CARBOXAMIDES AND USE THEREOF IN THE FIELD OF BLOOD COAGULATION BAYER IP GMBH (DE) 2012-11-21 EP disclosed
US-20100184740-A1 SUBSTITUTED OXAZOLIDINONES AND THEIR USE BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-07-22 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 (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 MAPT 4772/4885ALDH1A1 523/4885LMNA 1045/4885
US-20100184740-A1 SUBSTITUTED OXAZOLIDINONES AND THEIR USE XDH, MPL, OXA1L MAPT 4772/4885ALDH1A1 523/4885LMNA 1045/4885

“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.