SCHEMBL1455286

SCHEMBL1455286

O=C(Nc1ccccc1)c1ccc(Cl)c([N+](=O)[O-])c1

nearest known ligand 0.90

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 9/20 0.90
MEN1 O00255 8/20 0.90
ALDH1A1 P00352 6/20 0.76
KDM4E B2RXH2 1/20 0.76
MAPT P10636 7/20 0.69
LMNA P02545 4/20 0.68
GAA P10253 2/20 0.68
HTT P42858 2/20 0.68
MAPK1 P28482 3/20 0.66
NPSR1 Q6W5P4 2/20 0.66
POLB P06746 1/20 0.66
XBP1 P17861 1/20 0.66
CYP3A4 P08684 1/20 0.66
TSHR P16473 1/20 0.66
TDP1 Q9NUW8 1/20 0.66
VCAM1 P19320 1/20 0.65
SMN1; SMN2 Q16637 4/20 0.65
HPGD P15428 1/20 0.65
NPC1 O15118 1/20 0.62
RAB9A P51151 1/20 0.62

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
SCHEMBL359543 0.89 MEN1 (0.72) KMT2AMEN1ALDH1A1KDM4EMAPT
SCHEMBL3604124 0.87 KMT2A (0.74) KMT2AMEN1ALDH1A1KDM4EMAPT
SCHEMBL8303947 0.87 ALDH1A1 (0.71) KMT2AMEN1ALDH1A1KDM4EMAPT
SCHEMBL1454119 0.86 KMT2A (0.73) KMT2AMEN1ALDH1A1KDM4EMAPT
SCHEMBL1455196 0.86 KMT2A (0.73) KMT2AMEN1ALDH1A1KDM4EMAPT
SCHEMBL5390788 0.86 KMT2A (0.69) KMT2AMEN1ALDH1A1KDM4EMAPT
SCHEMBL1455800 0.86 KMT2A (0.73) KMT2AMEN1ALDH1A1KDM4EMAPT
SCHEMBL27942800 0.86 KMT2A (0.72) KMT2AMEN1ALDH1A1KDM4EMAPT
SCHEMBL9237760 0.86 MEN1 (0.72) KMT2AMEN1ALDH1A1KDM4EMAPT
SCHEMBL1455478 0.85 MEN1 (0.68) KMT2AMEN1ALDH1A1KDM4EMAPT

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 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230225991-A1 COMPOUNDS FOR USE IN THE TREATMENT OF ACUTE INTERMITTENT PORPHYRIA VESTLANDETS INNOVASJONSSELSKAP AS (NO) 2023-07-20 US disclosed
EP-4061347-A1 COMPOUNDS FOR USE IN THE TREATMENT OF ACUTE INTERMITTENT PORPHYRIA Vestlandets Innovasjonsselskap AS (NO) 2022-09-28 EP disclosed
WO-2021099803-A1 COMPOUNDS FOR USE IN THE TREATMENT OF ACUTE INTERMITTENT PORPHYRIA VESTLANDETS INNOVASJONSSELSKAP AS (NO) 2021-05-27 WO disclosed
US-8338605-B2 Anti-viral compounds ABBOTT LABORATORIES (US) 2012-12-25 US disclosed
US-8338605-B2 Anti-viral compounds ABBOTT LABORATORIES (US) 2012-12-25 US disclosed
US-8236950-B2 Anti-viral compounds ABBOTT LABORATORIES (US) 2012-08-07 US disclosed
US-8236950-B2 Anti-viral compounds ABBOTT LABORATORIES (US) 2012-08-07 US disclosed
EP-1979348-B1 ANTI-VIRAL COMPOUNDS ABBOTT LAB (US) 2012-01-18 EP disclosed
US-20110160233-A1 ANTI-VIRAL COMPOUNDS ABBOTT LABORATORIES (US) 2011-06-30 US disclosed
US-20110160233-A1 ANTI-VIRAL COMPOUNDS ABBOTT LABORATORIES (US) 2011-06-30 US disclosed
US-7763731-B2 Anti-viral compounds ABBOTT LABORATORIES (US) 2010-07-27 US disclosed
EP-2094276-A2 ANTI-VIRAL COMPOUNDS Abbott Laboratories (US) 2009-09-02 EP disclosed
CN-101384591-A Antiviral compounds ABBOTT LAB (US) 2009-03-11 CN disclosed
WO-2008133753-A2 ANTI-VIRAL COMPOUNDS ABBOTT LABORATORIES (US) 2008-11-06 WO disclosed
EP-1979348-A2 ANTI-VIRAL COMPOUNDS Abbott Laboratories (US) 2008-10-15 EP disclosed
US-20070232645-A1 ANTI-VIRAL COMPOUNDS ABBVIE INC. 2007-10-04 US disclosed
US-20070232645-A1 ANTI-VIRAL COMPOUNDS ABBVIE INC. 2007-10-04 US disclosed
US-20070232627-A1 ANTI-VIRAL COMPOUNDS ABBVIE INC. 2007-10-04 US disclosed
US-20070232627-A1 ANTI-VIRAL COMPOUNDS ABBVIE INC. 2007-10-04 US disclosed
WO-2007076034-A2 ANTI-VIRAL COMPOUNDS ABBOTT LABORATORIES (US) 2007-07-05 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 (4 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-20110160233-A1 ANTI-VIRAL COMPOUNDS HAVCR2, MAVS, EIF2AK2 KMT2A 3566/4885MEN1 4571/4885ALDH1A1 2723/4885
US-20070232645-A1 ANTI-VIRAL COMPOUNDS HAVCR2, MAVS, EIF2AK2 KMT2A 3566/4885MEN1 4571/4885ALDH1A1 2723/4885
US-20070232627-A1 ANTI-VIRAL COMPOUNDS HAVCR2, MAVS, EIF2AK2 KMT2A 3566/4885MEN1 4571/4885ALDH1A1 2723/4885
US-20230225991-A1 COMPOUNDS FOR USE IN THE TREATMENT OF ACUTE INTERMITTENT PORPHYRIA HMBS, POR, CYP2A13 KMT2A 2673/4885MEN1 3892/4885ALDH1A1 968/4885

“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.