SCHEMBL5116338

SCHEMBL5116338

O=C1Cc2cc([N+](=O)[O-])ccc2N1C1CC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 2/20 0.53
▸ MEN1 O00255 2/20 0.53
▸ KMT2A Q03164 2/20 0.53
▸ POLB P06746 1/20 0.43
▸ APEX1 P27695 1/20 0.43
▸ CASP6 P55212 1/20 0.43
▸ CTDSP1 Q9GZU7 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ TDP2 O95551 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ ROCK1 Q13464 1/20 0.41
▸ OPRM1 P35372 6/20 0.41
▸ OPRL1 P41146 6/20 0.41
▸ OPRK1 P41145 5/20 0.41
▸ CHRNB4 P30926 1/20 0.41
▸ CHRNA3 P32297 1/20 0.41
▸ LMNA P02545 2/20 0.40
▸ MAPT P10636 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ TLR9 Q9NR96 1/20 0.40

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
SCHEMBL5998923 0.94 GAA (0.51) GAAMEN1KMT2APOLBAPEX1
SCHEMBL23055585 0.91 GAA (0.48) GAAMEN1KMT2APOLBAPEX1
SCHEMBL23055860 0.87 GAA (0.50) GAAMEN1KMT2APOLBAPEX1
SCHEMBL23055853 0.86 GAA (0.46) GAAMEN1KMT2APOLBAPEX1
SCHEMBL23055514 0.85 KMT2A (0.48) GAAMEN1KMT2APOLBAPEX1
SCHEMBL23055858 0.83 MEN1 (0.42) GAAMEN1KMT2ATDP1ALDH1A1
SCHEMBL18019506 0.81 HTT (0.44) GAAMEN1KMT2APOLBAPEX1
SCHEMBL23055529 0.81 KCNH2 (0.56) MEN1KMT2AALDH1A1LMNAMAPT
SCHEMBL7295222 0.79 ADRA2A (0.44) GAAMEN1KMT2APOLBAPEX1
SCHEMBL2675840 0.79 ACHE (0.47) GAAKMT2APOLBAPEX1CASP6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080262056-A1 Oxindole Oxazolidinones as Antibacterial Agents PFIZER INC 2008-10-23 — — US disclosed
US-20060030609-A1 Oxazolidinones containing oxindoles as antibacterial agents LUEHR GARY W 2006-02-09 — — 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-20080262056-A1 Oxindole Oxazolidinones as Antibacterial Agents OXA1L, OXSR1, OXER1 GAA 4276/4885MEN1 1724/4885KMT2A 4240/4885
US-20060030609-A1 Oxazolidinones containing oxindoles as antibacterial agents OXA1L, OXSR1, OXER1 GAA 4408/4885MEN1 1292/4885KMT2A 3894/4885

“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.

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