SCHEMBL6199167

SCHEMBL6199167

Cc1nc2cc([N+](=O)[O-])c([N+](=O)[O-])cc2n1C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.53
▸ LMNA P02545 3/20 0.53
▸ MAPT P10636 3/20 0.53
▸ HTT P42858 2/20 0.53
▸ NPSR1 Q6W5P4 1/20 0.53
▸ ALDH1A1 P00352 3/20 0.50
▸ GALR2 O43603 1/20 0.46
▸ POLB P06746 1/20 0.46
▸ NPC1 O15118 3/20 0.45
▸ RAB9A P51151 3/20 0.45
▸ CHRNB2 P17787 1/20 0.41
▸ CHRNA4 P43681 1/20 0.41
▸ GAA P10253 1/20 0.40
▸ CYP3A4 P08684 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ HPGD P15428 2/20 0.38
▸ MEN1 O00255 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ GLA P06280 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL31613168 0.89 KDM4E (0.46) KDM4ELMNAMAPTHTTNPSR1
SCHEMBL30896394 0.89 LMNA (0.46) KDM4ELMNAMAPTHTTNPSR1
SCHEMBL11561933 0.82 CYP1A2 (0.43) KDM4ELMNAMAPTHTTNPSR1
SCHEMBL30896312 0.77 KDM4E (0.40) KDM4ELMNAMAPTHTTNPSR1
SCHEMBL30896380 0.77 ALDH1A1 (0.40) KDM4ELMNAMAPTHTTALDH1A1
SCHEMBL588563 0.77 RAB9A (0.62) KDM4ELMNAMAPTHTTNPSR1
SCHEMBL2481608 0.77 RAB9A (0.52) KDM4ELMNAMAPTHTTALDH1A1
SCHEMBL13916682 0.77 KDM4E (0.69) KDM4ELMNAMAPTHTTALDH1A1
Ammonia Solution, Strong SCHEMBL20358007 0.76 RAB9A (0.60) KDM4ELMNAMAPTHTTNPSR1
Ammonia Solution, Strong SCHEMBL29063683 0.76 RAB9A (0.51) KDM4ELMNAMAPTHTTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1228072-B1 PDGF RECEPTOR KINASE INHIBITORY COMPOUNDS, THEIR PREPARATION, PURIFICATION AND PHARMACEUTICAL COMPOSITIONS INCLUDING SAME YISSUM RES DEV CO (IL) 2005-09-28 — — EP disclosed
US-20040157852-A1 Tricyclic quinoxaline derivatives as protein tyrosine kinase inhibitors SUGEN, INC. 2004-08-12 — — US disclosed
US-20040132725-A1 PDGF receptor kinase inhibitory compounds, their preparation, purification and pharmaceutical compositions including same LEVITZKI ALEXANDER (IL) 2004-07-08 — — US disclosed
US-6673798-B2 PLATELET DERIVED GROWTH FACTORS (PDGF); 1,2-DIMETHYL-6-(2-THIOPHENE)IMIDAZOLO(5,4-G)QUINOXALINE PREPARATIONS FOR EXAMPLE; USE TREATING PROLIFERATIVE MALIGNANT AND NON-MALIGNANT DISEASES; STENTS YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM (IL) 2004-01-06 — — US disclosed
US-6656940-B2 Treatment of cancer. SUGEN, INC. 2003-12-02 — — US disclosed
EP-1228072-A4 PDGF RECEPTOR KINASE INHIBITORY COMPOUNDS, THEIR PREPARATION, PURIFICATION AND PHARMACEUTICAL COMPOSITIONS INCLUDING SAME YISSUM RES DEV CO (IL) 2003-05-07 — — EP disclosed
EP-1228072-A1 PDGF RECEPTOR KINASE INHIBITORY COMPOUNDS, THEIR PREPARATION, PURIFICATION AND PHARMACEUTICAL COMPOSITIONS INCLUDING SAME Yissum Research Development Company of the Hebrew University of Jerusalem (IL) 2002-08-07 — — EP disclosed
US-20020055511-A1 Tricyclic quinoxaline derivatives as protein tyrosine kinase inhibitors SUGEN, INC. 2002-05-09 — — US disclosed
US-6358954-B1 IMIDAZO(4,5-G)QUINOXALINE DERIVATIVES; ANTITUMOR, ANTICARCINOGENIC AND ANTIPROLIFERATIVE AGENTS YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM (IL) 2002-03-19 — — US disclosed
US-20020028817-A1 PDGF receptor kinase inhibitory compounds, their preparation, purification and pharmaceutical compositions including same YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM 2002-03-07 — — US disclosed
US-6329375-B1 ENZYME INHIBITORS AND ANTIINFLAMMATORY AGENTS SUGEN, INC. 2001-12-11 — — US disclosed
WO-2001034607-A1 PDGF RECEPTOR KINASE INHIBITORY COMPOUNDS, THEIR PREPARATION, PURIFICATION AND PHARMACEUTICAL COMPOSITIONS INCLUDING SAME YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM (IL) 2001-05-17 — — WO disclosed
WO-1999007701-A1 TRICYCLIC QUINOXALINE DERIVATIVES AS PROTEIN TYROSINE KINASE INHIBITORS SUGEN, INC. (US) 1999-02-18 — — 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-20020055511-A1 Tricyclic quinoxaline derivatives as protein tyrosine kinase inhibitors PDXK, TK1, ABL1 KDM4E 1597/4885LMNA 3816/4885MAPT 3699/4885
US-20020028817-A1 PDGF receptor kinase inhibitory compounds, their preparation, purification and pharmaceutical compositions including same PDGFRB, PDGFRA, PDGFA KDM4E 2256/4885LMNA 3811/4885MAPT 3006/4885
US-20040157852-A1 Tricyclic quinoxaline derivatives as protein tyrosine kinase inhibitors PDXK, TK1, ABL1 KDM4E 1597/4885LMNA 3816/4885MAPT 3699/4885
US-20040132725-A1 PDGF receptor kinase inhibitory compounds, their preparation, purification and pharmaceutical compositions including same PDGFRB, PDGFRA, PDGFA KDM4E 2256/4885LMNA 3811/4885MAPT 3006/4885

“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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