SCHEMBL6735384

SCHEMBL6735384

CC(C)c1cc(C=O)oc1[N+](=O)[O-]

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.38
ALDH1A1 P00352 3/20 0.37
HPGD P15428 1/20 0.37
MEN1 O00255 1/20 0.36
POLB P06746 1/20 0.36
KMT2A Q03164 1/20 0.36
PDK1 Q15118 1/20 0.32
KDM4E B2RXH2 1/20 0.30
CYP3A4 P08684 1/20 0.30
ALOX15 P16050 1/20 0.30
PRKDC P78527 1/20 0.30
HSD17B10 Q99714 1/20 0.30
CYP2A6 P11509 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
SCHEMBL12914086 0.72 CYP2A6 (0.34) ALDH1A1POLBCYP2A6
SCHEMBL2406497 0.72 CYP2A6 (0.34) ALDH1A1POLBCYP2A6
SCHEMBL28017359 0.66 TSHR (0.42) MAPTALDH1A1HPGDMEN1POLB
SCHEMBL6198657 0.63 ALDH1A1 (0.33) MAPTALDH1A1HPGDMEN1POLB
SCHEMBL27445737 0.62 ALDH5A1 (0.53) MAPTALDH1A1HPGDPDK1
SCHEMBL10937606 0.61 PDK1 (0.50) MAPTALDH1A1MEN1POLBKMT2A
SCHEMBL9164494 0.59 TSHR (0.38) MAPTALDH1A1HPGDMEN1POLB
SCHEMBL28132695 0.59 TSHR (0.38) MAPTALDH1A1HPGDMEN1POLB
SCHEMBL14369940 0.58 TSHR (0.52) MAPTALDH1A1HPGDMEN1POLB
SCHEMBL9004707 0.58 FABP4 (0.45) MAPTALDH1A1HPGDMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040242591-A1 Oxazolidinone derivatives as pontential antimicrobials RANBAXY LABORATORIES LIMITED (IN) 2004-12-02 US disclosed
EP-1409464-A1 OXAZOLIDINONE DERIVATIVES AS POTENTIAL ANTIMICROBIALS RANBAXY LABORATORIES, LTD. (IN) 2004-04-21 EP disclosed
WO-2003008389-A1 OXAZOLIDINONE DERIVATIVES AS POTENTIAL ANTIMICROBIALS RANBAXY LABORATORIES LIMITED (IN) 2003-01-30 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 (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-20040242591-A1 Oxazolidinone derivatives as pontential antimicrobials PDK4, OXA1L, PPARD MAPT 1094/4885ALDH1A1 1234/4885HPGD 1137/4885

“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.