SCHEMBL5336435

SCHEMBL5336435

Nc1ccc2[nH]c3ccc([N+](=O)[O-])cc3c(=O)c2c1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSV O60911 4/20 0.70
CTSL P07711 4/20 0.70
MEN1 O00255 3/20 0.61
MAPT P10636 3/20 0.61
KMT2A Q03164 3/20 0.61
ALDH1A1 P00352 3/20 0.61
LMNA P02545 2/20 0.61
NPC1 O15118 1/20 0.61
HSP90AA1 P07900 1/20 0.61
RAB9A P51151 1/20 0.61
NPSR1 Q6W5P4 1/20 0.61
L3MBTL1 Q9Y468 1/20 0.61
CA12 O43570 2/20 0.56
CA9 Q16790 2/20 0.56
PARP1 P09874 2/20 0.54
GABRA1 P14867 1/20 0.51
GABRG2 P18507 1/20 0.51
GABRB3 P28472 1/20 0.51
GABRA5 P31644 1/20 0.51
GABRA2 P47869 1/20 0.51

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
SCHEMBL31473181 1.00 CTSV (0.70) CTSVCTSLMEN1MAPTKMT2A
SCHEMBL31473183 0.93 CTSV (0.65) CTSVCTSLMEN1MAPTKMT2A
SCHEMBL5333298 0.93 CTSV (0.69) CTSVCTSLMEN1MAPTKMT2A
SCHEMBL30272747 0.92 GABRA1 (0.59) CTSVCTSLMEN1MAPTKMT2A
SCHEMBL2439209 0.84 CTSV (0.57) CTSVCTSLMEN1MAPTKMT2A
SCHEMBL5342370 0.83 PARP1 (0.58) MEN1MAPTKMT2AALDH1A1LMNA
SCHEMBL21828651 0.83 CTSV (1.00) CTSVCTSLMEN1MAPTKMT2A
SCHEMBL29519210 0.83 CTSV (1.00) CTSVCTSLMEN1MAPTKMT2A
SCHEMBL11424504 0.82 ALDH1A1 (0.52) CTSVCTSLMEN1MAPTKMT2A
SCHEMBL21828647 0.81 CTSV (0.70) CTSVCTSLMEN1MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7300930-B2 Therapeutic acridone and acridine compounds CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2007-11-27 US disclosed
US-7300930-B2 Therapeutic acridone and acridine compounds CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2007-11-27 US disclosed
US-7300930-B2 Therapeutic acridone and acridine compounds CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2007-11-27 US disclosed
US-7205311-B2 Therapeutic acridone and acridine compounds CANCER RESEARCH TECHNOLOGY LIMITED 2007-04-17 US disclosed
US-7160896-B2 Therapeutic acridone and acridine compounds CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2007-01-09 US disclosed
US-7160896-B2 Therapeutic acridone and acridine compounds CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2007-01-09 US disclosed
US-7160896-B2 Therapeutic acridone and acridine compounds CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2007-01-09 US disclosed
US-20060111389-A1 Therapeutic acridone and acridine compounds CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2006-05-25 US disclosed
EP-1363888-A2 THERAPEUTIC ACRIDONE AND ACRIDINE COMPOUNDS Cancer Research Technology Limited (GB) 2003-11-26 EP disclosed
US-20030207909-A1 Therapeutic acridone and acridine compounds CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2003-11-06 US disclosed
WO-2002008193-A2 THERAPEUTIC ACRIDONE AND ACRIDINE COMPOUNDS CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2002-01-31 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 (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-20030207909-A1 Therapeutic acridone and acridine compounds NAT1, TERT, CCNA1 CTSV 3412/4885CTSL 1904/4885MEN1 2403/4885
US-20060111389-A1 Therapeutic acridone and acridine compounds TERT, ACIN1, NAT1 CTSV 3330/4885CTSL 2241/4885MEN1 3044/4885

“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.