SCHEMBL789047

SCHEMBL789047

[2H]C1([2H])Oc2ccc([N+](=O)[O-])cc2O1

nearest known ligand 0.67

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.47
RAB9A P51151 6/20 0.47
MEN1 O00255 5/20 0.47
KMT2A Q03164 5/20 0.47
NPC1 O15118 4/20 0.47
SMN1; SMN2 Q16637 4/20 0.47
LMNA P02545 2/20 0.47
MAPK1 P28482 1/20 0.47
CHRNB4 P30926 4/20 0.44
CHRNA3 P32297 4/20 0.44
ALDH1A1 P00352 4/20 0.44
CRHBP P24387 1/20 0.44
CRHR2 Q13324 1/20 0.44
GAA P10253 1/20 0.44
HPGD P15428 1/20 0.44
BAZ1A Q9NRL2 1/20 0.43
HTT P42858 1/20 0.43
PTPN1 P18031 1/20 0.43

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
SCHEMBL30448936 0.85 MAPT (0.59) MAPTRAB9AMEN1KMT2ANPC1
SCHEMBL141303 0.85 MAPT (0.59) MAPTRAB9AMEN1KMT2ANPC1
SCHEMBL1169369 0.85 MAPT (0.60) MAPTRAB9AMEN1KMT2ANPC1
SCHEMBL30665998 0.85 MAPT (0.60) MAPTRAB9AMEN1KMT2ANPC1
SCHEMBL25355624 0.82 MEN1 (0.56) MAPTRAB9AMEN1KMT2ANPC1
SCHEMBL10845095 0.81 MEN1 (0.54) MAPTRAB9AMEN1KMT2ANPC1
Formaldehyde SCHEMBL27922643 0.81 MAPT (0.56) MAPTRAB9AMEN1KMT2ANPC1
SCHEMBL31474894 0.80 MAPT (0.56) MAPTRAB9AMEN1KMT2ANPC1
SCHEMBL14849221 0.80 MAPT (0.56) MAPTRAB9AMEN1KMT2ANPC1
SCHEMBL20774271 0.80 MAPT (0.56) MAPTRAB9AMEN1KMT2ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3327140-A1 CAPTURE PROBES IMMOBILIZABLE VIA L-NUCLEOTIDE TAIL Gen-Probe Incorporated (US) 2018-05-30 EP claimed
US-9938590-B2 Capture probes immobilizable via L-nucleotide tail GEN-PROBE INCORPORATED (US) 2018-04-10 US claimed
EP-2616555-B1 CAPTURE PROBES IMMOBILIZABLE VIA L-NUCLEOTIDE TAIL GEN PROBE INC (US) 2017-11-08 EP claimed
US-20130260368-A1 Capture Probes Immobilizable Via L-Nucleotide Tail GEN-PROBE INCORPORATED (US) 2013-10-03 US claimed
EP-2616555-A1 CAPTURE PROBES IMMOBILIZABLE VIA L-NUCLEOTIDE TAIL Gen-Probe Incorporated (US) 2013-07-24 EP claimed
WO-2012037531-A1 CAPTURE PROBES IMMOBILIZABLE VIA L-NUCLEOTIDE TAIL GEN-PROBE INCORPORATED (US) 2012-03-22 WO claimed
US-11035012-B2 Capture probes immobilizable via L-nucleotide tail GEN-PROBE INCORPORATED (US) 2021-06-15 US disclosed
US-20180251862-A1 Capture Probes Immobilizable Via L-Nucleotide Tail BANK OF AMERICA, N.A., AS COLLATERAL AGENT 2018-09-06 US disclosed
EP-3327140-A1 CAPTURE PROBES IMMOBILIZABLE VIA L-NUCLEOTIDE TAIL Gen-Probe Incorporated (US) 2018-05-30 EP disclosed
US-9938590-B2 Capture probes immobilizable via L-nucleotide tail GEN-PROBE INCORPORATED (US) 2018-04-10 US disclosed
EP-2616555-B1 CAPTURE PROBES IMMOBILIZABLE VIA L-NUCLEOTIDE TAIL GEN PROBE INC (US) 2017-11-08 EP disclosed
US-20140371238-A1 COMPOUNDS AND METHODS FOR THE TREATMENT OF CYSTIC FIBROSIS FLATLEY DISCOVERY LAB (US) 2014-12-18 US disclosed
US-20130260368-A1 Capture Probes Immobilizable Via L-Nucleotide Tail GEN-PROBE INCORPORATED (US) 2013-10-03 US disclosed
EP-2616555-A1 CAPTURE PROBES IMMOBILIZABLE VIA L-NUCLEOTIDE TAIL Gen-Probe Incorporated (US) 2013-07-24 EP disclosed
WO-2012037531-A1 CAPTURE PROBES IMMOBILIZABLE VIA L-NUCLEOTIDE TAIL GEN-PROBE INCORPORATED (US) 2012-03-22 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-20140371238-A1 COMPOUNDS AND METHODS FOR THE TREATMENT OF CYSTIC FIBROSIS CFTR, SERPINB1, ELANE MAPT 4865/4885RAB9A 2575/4885MEN1 2712/4885

“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.