SCHEMBL4451329

SCHEMBL4451329

N=C(N)Nc1ccccc1C(=O)Oc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 5/20 0.50
▸ ALDH1A1 P00352 3/20 0.50
▸ PKM P14618 1/20 0.48
▸ HGFAC Q04756 1/20 0.46
▸ MAPT P10636 3/20 0.46
▸ KDM4E B2RXH2 2/20 0.46
▸ GAA P10253 2/20 0.45
▸ SMN1; SMN2 Q16637 2/20 0.45
▸ PPARG P37231 1/20 0.45
▸ MEN1 O00255 3/20 0.44
▸ RAB9A P51151 4/20 0.44
▸ NPC1 O15118 3/20 0.44
▸ MYC P01106 1/20 0.43
▸ MAX P61244 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
Hydrochloric Acid SCHEMBL6888440 0.99 KMT2A (0.49) KMT2AALDH1A1PKMHGFACMAPT
SCHEMBL10677499 0.84 HPGD (0.51) KMT2AALDH1A1MAPTKDM4EGAA
SCHEMBL5078869 0.81 ALDH1A1 (0.56) KMT2AALDH1A1MAPTKDM4EGAA
SCHEMBL10699436 0.78 CA2 (0.46) ALDH1A1MAPTKDM4E
SCHEMBL11417908 0.78 PRSS1 (0.47) ALDH1A1KDM4EGAA
SCHEMBL4256409 0.77 RAB9A (0.64) KMT2AALDH1A1PKMHGFACMAPT
SCHEMBL30258384 0.77 RAB9A (0.64) KMT2AALDH1A1PKMHGFACMAPT
SCHEMBL237695 0.77 KMT2A (0.64) KMT2AALDH1A1PKMHGFACMAPT
Hydrochloric Acid SCHEMBL377076 0.76 KMT2A (0.63) KMT2AALDH1A1PKMHGFACMAPT
Guanidine SCHEMBL3748808 0.76 KMT2A (0.67) KMT2AALDH1A1PKMHGFACMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5955100-A TREATMENT OF MALIGNANT TUMORS, INFLAMMATORY DISEASES, OR AUTOIMMUNE DISEASES BEHRINGWERKE AKTIENGESELLSCHAFT (DE) 1999-09-21 — — US claimed
US-20200121703-A1 CANCER TREATMENT THE CLEVELAND CLINIC FOUNDATION 2020-04-23 — — US disclosed
WO-2019005754-A1 CANCER TREATMENT THE CLEVELAND CLINIC FOUNDATION (US) 2019-01-03 — — WO disclosed
US-20110300147-A9 Inhibiting tumor cell invasion, metastasis and angiogenesis THE SCRIPPS RESEARCH INSTITUTE (US) 2011-12-08 — — US disclosed
US-20090175873-A1 Inhibiting tumor cell invasion, metastasis and angiogenesis THE SCRIPPS RESEARCH INSTITUTE (US) 2009-07-09 — — US disclosed
EP-1731164-A1 Methods for using the obese gene and its gene product to stimulate hematopoietic development Indevus Pharmaceuticals, Inc. (US) 2006-12-13 — — EP disclosed
EP-0892849-B1 METHODS FOR USING THE OBESE GENE AND ITS GENE PRODUCT TO STIMULATE HEMATOPOIETIC DEVELOPMENT INDEVUS PHARMACEUTICALS INC (US) 2006-03-15 — — EP disclosed
US-20050158287-A1 Methods for using the obese gene and its gene product to identify hematopoietic progenitor cells INDEVUS PHARMACEUTICALS, INC. 2005-07-21 — — US disclosed
US-6838079-B2 Methods for using the obese product to stimulate hematopoietic development INDEVUS PHARMACEUTICALS, INC. (US) 2005-01-04 — — US disclosed
US-20030186345-A1 Macromolecular enzyme substrates GOVERNMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES, NATIONAL INSTITUTES OF HEALTH, THE 2003-10-02 — — US disclosed
US-6146658-A ADMINISTERING A GLYCOSYL-SPACER-DRUG COMPOUND WHERE THE GLYCOSYL IS A SACCHARIDE WHICH CAN BE ENZYMATICALLY CLEAVED; DRUG IS ANTIINFLAMMATORY, IMMUNOSUPPRESSIVE OR ANTITUMOR AGENT WHICH HYDROXYL OR AMINO GROUP; SELF-ELIMINATING SPACER HOECHST AKTIENGESELLSCHAFT (DE) 2000-11-14 — — US disclosed
EP-0467932-B1 UROKINASE-TYPE PLASMINOGEN ACTIVATOR RECEPTOR CANCERFORSKNINGSFONDEN AF 1989 (DK) 2000-10-18 — — EP disclosed
EP-1013285-A2 Urokinase-type plasminogen activator receptor Cancerforskningsfonden af 1989 (fonden til fremme af eksperimentel cancerforskning) (DK) 2000-06-28 — — EP disclosed
US-5955100-A TREATMENT OF MALIGNANT TUMORS, INFLAMMATORY DISEASES, OR AUTOIMMUNE DISEASES BEHRINGWERKE AKTIENGESELLSCHAFT (DE) 1999-09-21 — — US disclosed
US-5891664-A Vectors and methods for recombinant production of uPA-binding fragments of the human urokinase-type plasminogen receptor (uPAR) CANCERFORSKNINGSFONDET AF 1989 (DK) 1999-04-06 — — US disclosed
WO-1995000847-A1 IMMUNOASSAY HAFSLUND NYCOMED A.S (NO) 1995-01-05 — — WO disclosed
US-5274162-A Antineoplastic drugs with bipolar toxification/detoxification functionalities GLAZIER ARNOLD (US) 1993-12-28 — — US disclosed
WO-1993009233-A2 RECOMBINANT AMYLOID PRECURSOR PROTEIN INHIBITOR DOMAIN AND TREATMENT OF VARIOUS DISEASE STATES THE SALK INSTITUTE BIOTECHNOLOGY/INDUSTRIAL ASSOCIATES INC. (US) 1993-05-13 — — WO disclosed
EP-0467932-A1 UROKINASE-TYPE PLASMINOGEN ACTIVATOR RECEPTOR Cancerforskningsfonden af 1989 (fonden til fremme af eksperimentel cancerforskning) (DK) 1992-01-29 — — EP disclosed
WO-1990012091-A1 UROKINASE-TYPE PLASMINOGEN ACTIVATOR RECEPTOR CANCERFORSKNINGSFONDET AF 1989 (DK) 1990-10-18 — — 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 (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-20090175873-A1 Inhibiting tumor cell invasion, metastasis and angiogenesis MMP9, TIMP3, MMP3 KMT2A 3581/4885ALDH1A1 743/4885PKM 3004/4885
US-20110300147-A9 Inhibiting tumor cell invasion, metastasis and angiogenesis MMP9, TIMP3, MMP3 KMT2A 3581/4885ALDH1A1 743/4885PKM 3004/4885

“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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