SCHEMBL7594307

SCHEMBL7594307

COC(=O)c1c(C)c([N+](=O)[O-])cc2nc(Cl)c(Cl)nc12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
LMNA P02545 4/20 0.38
MAPT P10636 3/20 0.37
POLB P06746 2/20 0.37
MAPK1 P28482 2/20 0.37
PDGFRB P09619 1/20 0.36
FGFR1 P11362 1/20 0.36
PDGFRA P16234 1/20 0.36
FLT1 P17948 1/20 0.36
FGFR3 P22607 1/20 0.36
KDR P35968 1/20 0.36
ATM Q13315 2/20 0.36
HTT P42858 1/20 0.36
GALR2 O43603 1/20 0.36
PIM3 Q86V86 1/20 0.36
PGK1 P00558 1/20 0.36
KDM4E B2RXH2 3/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
ALDH1A1 P00352 2/20 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
SCHEMBL7592279 0.85 SMN1; SMN2 (0.38) KMT2AMEN1LMNAMAPTPOLB
SCHEMBL7825789 0.81 CSNK2A1 (0.40) KMT2AMEN1MAPTPOLBMAPK1
SCHEMBL7961783 0.79 LMNA (0.41) LMNAPOLBATMHTTGALR2
SCHEMBL23118260 0.75 PDGFRB (0.44) KMT2AMEN1LMNAMAPTPOLB
SCHEMBL7596330 0.74 LMNA (0.36) KMT2AMEN1LMNAMAPTPOLB
SCHEMBL30562612 0.74 MAPT (0.43) KMT2AMEN1LMNAMAPTPOLB
SCHEMBL25388587 0.74 MAPT (0.43) KMT2AMEN1LMNAMAPTPOLB
SCHEMBL22804433 0.73 LMNA (0.43) KMT2AMEN1LMNAMAPTPOLB
SCHEMBL7593494 0.73 TPMT (0.41) KMT2AMEN1LMNAMAPTHTT
SCHEMBL7598494 0.72 KMT2A (0.38) KMT2AMEN1LMNAMAPTPOLB

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-6455698-B1 FOR TREATING CEREBRAL ISCHEMIA OR CEREBRAL INFARCTION RESULTING FROM THROMBOEMBOLIC OR HEMORRHAGIC STROKE, CEREBRAL VASOSPASMS, HYPOGLYCEMIA, CARDIAC ARREST, NEURODEGENERATIVE DISORDERS WARNER-LAMBERT COMPANY 2002-09-24 US disclosed
US-20020065415-A1 Conformationally semi-constrained quinoxaline 2,3-diones as neuroprotective agents KORNBERG BRIAN EDWARD (US) 2002-05-30 US disclosed
US-6340758-B1 DRUGS AS NEUROPROTECTIVE AGENTS INVENTION MAY ALSO BE USEFUL IN THE TREATMENT OF SCHIZOPHRENIA, EPILEPSY, ANXIETY, PAIN AND DRUG ADDICTION. WARNER-LAMBERT COMPANY 2002-01-22 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 (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-20020065415-A1 Conformationally semi-constrained quinoxaline 2,3-diones as neuroprotective agents CBR1, CBR3, CHRNA7 KMT2A 3481/4885MEN1 4080/4885LMNA 1494/4885

“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.