SCHEMBL4943709

SCHEMBL4943709

Nc1ccccc1Nc1ccccn1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.73
KMT2A Q03164 4/20 0.73
MAPK10 P53779 2/20 0.73
GFER P55789 1/20 0.73
HDAC3 O15379 2/20 0.51
HDAC4 P56524 2/20 0.51
HDAC1 Q13547 2/20 0.51
HDAC7 Q8WUI4 2/20 0.51
HDAC2 Q92769 2/20 0.51
HDAC10 Q969S8 2/20 0.51
HDAC11 Q96DB2 2/20 0.51
HDAC8 Q9BY41 2/20 0.51
HDAC6 Q9UBN7 2/20 0.51
HDAC9 Q9UKV0 2/20 0.51
HDAC5 Q9UQL6 2/20 0.51
MAPT P10636 4/20 0.50
KDM4E B2RXH2 3/20 0.50
GAA P10253 3/20 0.50
ALDH1A1 P00352 2/20 0.50
LMNA P02545 2/20 0.50

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
SCHEMBL2501726 0.86 KMT2A (0.70) MEN1KMT2AMAPK10GFERHDAC3
SCHEMBL3279571 0.85 MEN1 (1.00) MEN1KMT2AMAPK10GFERGAA
SCHEMBL8686406 0.82 MAPK10 (0.58) MEN1KMT2AMAPK10GFERHDAC3
SCHEMBL16089597 0.82 MAPK10 (0.58) MEN1KMT2AMAPK10GFERMAPT
SCHEMBL1518700 0.79 MAPK10 (1.00) MEN1KMT2AMAPK10GFERHDAC3
SCHEMBL7677416 0.79 MAPK10 (0.56) MEN1KMT2AMAPK10GFERHDAC3
SCHEMBL8401982 0.79 MAPK10 (0.55) MEN1KMT2AMAPK10GFERHDAC3
SCHEMBL6832802 0.79 MEN1 (0.55) MEN1KMT2AMAPK10GFERMAPT
SCHEMBL19024050 0.79 MEN1 (0.55) MEN1KMT2AMAPK10GFERHDAC3
SCHEMBL4926590 0.79 MEN1 (0.55) MEN1KMT2AMAPK10GFERHDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130172570-A1 METHOD OF MAKING BENZAZOLES US GOVERNMENT AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) 2013-07-04 US disclosed
US-20130172570-A1 METHOD OF MAKING BENZAZOLES US GOVERNMENT AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) 2013-07-04 US disclosed
US-7939663-B2 Phosphor metallic compound and an organic electroluminescence device having improved luminous efficiency and color purity; long lifespan; highly efficient phosphor host material SAMSUNG ELECTRONICS CO., LTD. (KR) 2011-05-10 US disclosed
US-20080275239-A1 Metallic Compound and Organic Electroluminescence Device Comprising the Same SAMSUNG ELECTRONICS CO., LTD., (KR) 2008-11-06 US disclosed
US-20080207659-A1 INHIBITORS OF PHOSPHODIESTERASE TYPE 4 RANBAXY LABORATORIES LIMITED (IN) 2008-08-28 US disclosed
US-20080161366-A1 AMINOALKYL SUBSTITUTED ARYL SULFAMIDE DERIVATIVES AND METHODS OF THEIR USE WYETH (US) 2008-07-03 US disclosed
US-20040181062-A1 Benzimidazole cyclooxygenase-2 inhibitor PFIZER INC 2004-09-16 US disclosed
US-6713482-B2 SUCH AS (E)-1-(2-PYRIDYL)-2-STYRYL-1H-BENZIMIDAZOLE; ANTIINFLAMMATORY AND ANALGESIC AGENTS; PROSTAGLANDIN INHIBITORS PFIZER INC. 2004-03-30 US disclosed
US-20030013886-A1 Benzimidazole cyclooxygenase-2 inhibitors OKUMURA YOSHIYUKI (JP) 2003-01-16 US disclosed
EP-0937722-B1 Benzimidazole derivatives as cyclooxygenase-2 inhibitors PFIZER (US) 2002-07-03 EP disclosed
US-6310079-B1 NON-STEROIDAL ANTIINFLAMMATORY AGENTS PFIZER INC. 2001-10-30 US disclosed
EP-0937722-A1 Benzimidazole derivatives as cyclooxygenase-2 inhibitors PFIZER INC. (US) 1999-08-25 EP disclosed
EP-0756602-B1 CCK OR GASTRIN MODULATING 5-HETEROCYCLIC-1,5-BENZODIAZEPINES GLAXO WELLCOME INC (US) 1999-06-30 EP disclosed
US-5739129-A AGONIST ACTIVITY GLAXO WELLCOME INC. (US) 1998-04-14 US disclosed
CN-1176646-A CCK or gastrin modulating 5 -heterocyclic-1, 5-benzodiazepines GLAXO WELLCOME INC (US) 1998-03-18 CN 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 (6 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-20080207659-A1 INHIBITORS OF PHOSPHODIESTERASE TYPE 4 PDE4A, PDE4B, PDE4C MEN1 4784/4885KMT2A 4487/4885MAPK10 1078/4885
US-20080161366-A1 AMINOALKYL SUBSTITUTED ARYL SULFAMIDE DERIVATIVES AND METHODS OF THEIR USE SLC6A4, SLC6A2, SLC6A3 MEN1 4156/4885KMT2A 1555/4885MAPK10 1199/4885
US-20080275239-A1 Metallic Compound and Organic Electroluminescence Device Comprising the Same SCO2, NFE2L2, SOD1 MEN1 108/4885KMT2A 1787/4885MAPK10 1393/4885
US-20130172570-A1 METHOD OF MAKING BENZAZOLES NBAS, CBR3, CBR1 MEN1 2940/4885KMT2A 2290/4885MAPK10 4804/4885
US-20030013886-A1 Benzimidazole cyclooxygenase-2 inhibitors PTGS1, CBR1, CBR3 MEN1 4840/4885KMT2A 1611/4885MAPK10 3836/4885
US-20040181062-A1 Benzimidazole cyclooxygenase-2 inhibitor PTGS1, CBR1, CBR3 MEN1 4821/4885KMT2A 1403/4885MAPK10 3964/4885

“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.