SCHEMBL2796205

SCHEMBL2796205

CCOC(=O)N1CCC(CCCn2c(=O)ccc3ccc(OC)cc32)(C(=O)OCC)CC1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 9/20 0.44
MEN1 O00255 8/20 0.44
POLB P06746 3/20 0.44
ALDH1A1 P00352 9/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
MAPT P10636 2/20 0.42
KDM4E B2RXH2 1/20 0.42
HTT P42858 1/20 0.42
LMNA P02545 3/20 0.41
GAA P10253 1/20 0.41

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
SCHEMBL2797642 0.93 PIK3CA (0.42) KMT2AMEN1POLBALDH1A1L3MBTL1
SCHEMBL2794583 0.88 POLB (0.41) KMT2AMEN1POLBALDH1A1L3MBTL1
SCHEMBL2793851 0.85 MEN1 (0.56) KMT2AMEN1POLBALDH1A1L3MBTL1
SCHEMBL2796440 0.85 POLB (0.59) KMT2AMEN1POLBALDH1A1L3MBTL1
SCHEMBL2797883 0.83 POLB (0.49) KMT2AMEN1POLBALDH1A1L3MBTL1
SCHEMBL11999866 0.83 ALDH1A1 (0.39) KMT2AMEN1POLBALDH1A1LMNA
SCHEMBL2795915 0.83 KDM4E (0.61) KMT2AMEN1POLBALDH1A1L3MBTL1
SCHEMBL2795909 0.83 KDM4E (0.61) KMT2AMEN1POLBALDH1A1L3MBTL1
SCHEMBL2794310 0.81 KMT2A (0.62) KMT2AMEN1POLBALDH1A1L3MBTL1
SCHEMBL2796986 0.81 PIK3CA (0.41) KMT2AMEN1POLBALDH1A1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8524738-B2 Quinolinones and quinoxalinones as antibacterial composition TOYAMA CHEMICAL CO., LTD. (JP) 2013-09-03 US disclosed
US-8329694-B2 Quinoxalinones as antibacterial composition TOYAMA CHEMICAL CO., LTD. (JP) 2012-12-11 US disclosed
US-20120214990-A1 QUINOLINONES AND QUINOXALINONES AS ANTIBACTERIAL COMPOSITION TAISHO PHARMACEUTICAL CO., LTD. (JP) 2012-08-23 US disclosed
EP-2468743-A1 Nitrogen-containing bicyclic compounds useful as antibacterial agents Toyama Chemical Co., Ltd. (JP) 2012-06-27 EP disclosed
US-20100168418-A1 NOVEL NITROGENATED HETEROCYCLIC COMPOUND AND SALT THEREOF TOYAMA CHEMICAL CO., LTD. (JP) 2010-07-01 US disclosed
EP-1900732-A1 NOVEL NITROGENATED HETEROCYCLIC COMPOUND AND SALT THEREOF TOYAMA CHEMICAL CO., LTD. (JP) 2008-03-19 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 (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-20100168418-A1 NOVEL NITROGENATED HETEROCYCLIC COMPOUND AND SALT THEREOF ROS1, NOX1, ARG1 KMT2A 1173/4885MEN1 1971/4885POLB 2770/4885
US-20120214990-A1 QUINOLINONES AND QUINOXALINONES AS ANTIBACTERIAL COMPOSITION NQO2, ASNS, NDUFS1 KMT2A 2354/4885MEN1 2461/4885POLB 314/4885

“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.