SCHEMBL7743046

SCHEMBL7743046

O=C(Nc1ccncc1)c1cccc([N+](=O)[O-])c1

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.81
MEN1 O00255 5/20 0.81
NPC1 O15118 3/20 0.80
RAB9A P51151 3/20 0.80
LMNA P02545 4/20 0.79
HPGD P15428 1/20 0.79
ATM Q13315 1/20 0.79
POLB P06746 3/20 0.70
SMN1; SMN2 Q16637 3/20 0.70
CACNA1B Q00975 1/20 0.70
APBA1 Q02410 1/20 0.70
MAPT P10636 4/20 0.69
BLM P54132 1/20 0.69
THRA P10827 1/20 0.69
ALDH1A1 P00352 2/20 0.66
MITF O75030 1/20 0.63
MAPK1 P28482 1/20 0.63
L3MBTL1 Q9Y468 1/20 0.62
NT5E P21589 1/20 0.61
CYP1A2 P05177 1/20 0.61

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
SCHEMBL25821827 0.90 BRAF (0.69) KMT2AMEN1NPC1RAB9ALMNA
SCHEMBL299879 0.87 KMT2A (0.88) KMT2AMEN1NPC1RAB9ALMNA
SCHEMBL30868371 0.87 KMT2A (0.88) KMT2AMEN1NPC1RAB9ALMNA
SCHEMBL6396333 0.86 LMNA (0.79) KMT2AMEN1NPC1RAB9ALMNA
SCHEMBL10943066 0.85 KMT2A (0.94) KMT2AMEN1NPC1RAB9ALMNA
SCHEMBL7079557 0.85 CYP11B1 (0.74) KMT2AMEN1RAB9ALMNAHPGD
SCHEMBL1888911 0.84 MAPT (0.77) KMT2AMEN1NPC1RAB9ALMNA
SCHEMBL25821902 0.84 LMNA (0.70) KMT2AMEN1NPC1RAB9ALMNA
SCHEMBL94830 0.84 KMT2A (0.88) KMT2AMEN1NPC1RAB9ALMNA
SCHEMBL27657642 0.84 KMT2A (0.88) KMT2AMEN1NPC1RAB9ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11427566-B2 Compounds useful for treating cancer ABIVAX (FR) 2022-08-30 US disclosed
US-20200239444-A1 COMPOUNDS USEFUL FOR TREATING CANCER ABIVAX (FR) 2020-07-30 US disclosed
US-10717724-B2 Compounds useful for treating cancer ABIVAX (FR) 2020-07-21 US disclosed
US-20180222888-A1 COMPOUNDS USEFUL FOR TREATING CANCER ABIVAX (FR) 2018-08-09 US disclosed
US-9969715-B2 Compounds useful for treating cancer ABIVAX (FR) 2018-05-15 US disclosed
CN-104903293-B Novel anti-invasive compounds ABIVAX公司 2016-08-24 CN disclosed
EP-2900635-B1 NEW ANTI-INVASIVE COMPOUNDS ABIVAX (FR) 2016-07-13 EP disclosed
US-20150315173-A1 NEW ANTI-INVASIVE COMPOUNDS UNIVERSITE DE MONTPELLIER (FR) 2015-11-05 US disclosed
CN-104903293-A Novel anti-invasive compounds ABIVAX 2015-09-09 CN disclosed
EP-2900635-A1 NEW ANTI-INVASIVE COMPOUNDS ABIVAX (FR) 2015-08-05 EP disclosed
EP-0622361-B1 Heterocyclic compounds as bradykinin antagonists FUJISAWA PHARMACEUTICAL CO (JP) 2001-10-04 EP disclosed
US-6169095-B1 FOR PREVENTION AND/OR TREATMENT OF BRADYKININ OR ITS ANALOGUES MEDIATED DISEASES IN THE EYE, SUCH AS ALLERGY, INFLAMMATION AND PAIN OF THE EYE FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-01-02 US disclosed
US-5922711-A ANTIALLERGENS, ANTIINFLAMMATORY AGENTS, AUTOIMMUNE DISEASES, SHOCK OR ANALGESICS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-07-13 US disclosed
EP-0596406-B1 Imidazo (1,2-a) Pyridines as bradykinin antagonists FUJISAWA PHARMACEUTICAL CO (JP) 1998-12-16 EP disclosed
US-5750699-A HALOGENATING OF CORRESPONDING COMPOUND FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-05-12 US disclosed
US-5708173-A PREPARATION OF SUBSTITUTED QUINOLINE COMPOUNDS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-01-13 US disclosed
US-5574042-A ANTAGONIST FOR BRADYKININS AS ANTIALLERGENS, AUTOIMMUNE DISEASES, ANTIINFLAMMATORY AGENTS, SHOCK OR PAIN FUJISAWA PHARMACEUTICAL CO., LTD (JP) 1996-11-12 US disclosed
US-5563162-A CAN BE ADMINISTERD FOR THE TREATMENT OF ALLERGY, INFLAMMATION, AUTOIMMUNE DISEASES, SHOCK OR PAIN IN ANIMALS AND HUMANS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-10-08 US disclosed
EP-0622361-A1 Heterocyclic compounds as bradykinin antagonists FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-11-02 EP disclosed
EP-0596406-A1 Imidazo (1,2-a) Pyridines as bradykinin antagonists FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-05-11 EP 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 (5 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-20180222888-A1 COMPOUNDS USEFUL FOR TREATING CANCER PRMT7, PRMT6, RRM2 KMT2A 2111/4885MEN1 493/4885NPC1 1881/4885
US-20150315173-A1 NEW ANTI-INVASIVE COMPOUNDS MIF, MMP7, MMP8 KMT2A 3485/4885MEN1 830/4885NPC1 520/4885
US-10717724-B2 Compounds useful for treating cancer PRMT7, PRMT6, RRM2 KMT2A 2111/4885MEN1 493/4885NPC1 1881/4885
US-20200239444-A1 COMPOUNDS USEFUL FOR TREATING CANCER PRMT7, PRMT6, RRM2 KMT2A 2003/4885MEN1 542/4885NPC1 2247/4885
US-11427566-B2 Compounds useful for treating cancer PRMT7, PRMT6, RRM2 KMT2A 2003/4885MEN1 542/4885NPC1 2247/4885

“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.