SCHEMBL589650

SCHEMBL589650

COc1ccc(COC(=O)c2cc(Br)nn2-c2ncccc2Cl)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
CASP3 P42574 1/20 0.46
SENP8 Q96LD8 1/20 0.46
SENP7 Q9BQF6 1/20 0.46
SENP6 Q9GZR1 1/20 0.46
ALDH1A1 P00352 1/20 0.41
MEN1 O00255 1/20 0.40
L3MBTL1 Q9Y468 3/20 0.39
DHODH Q02127 2/20 0.39
MAPK1 P28482 1/20 0.39
MMP9 P14780 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
MMP1 P03956 1/20 0.38
POLB P06746 1/20 0.38
TBXAS1 P24557 1/20 0.38
GRIN2B Q13224 1/20 0.38
MMP2 P08253 1/20 0.38
MMP12 P39900 1/20 0.38
SMPD1 P17405 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
SCHEMBL589486 0.89 POLB (0.49) KMT2ATDP1CASP3SENP8SENP7
SCHEMBL29372796 0.83 ALDH1A1 (0.47) TDP1ALDH1A1L3MBTL1DHODHMAPK1
SCHEMBL1762554 0.83 ALDH1A1 (0.47) TDP1ALDH1A1L3MBTL1DHODHMAPK1
SCHEMBL23249321 0.82 DHODH (0.45) ALDH1A1DHODHPOLB
SCHEMBL29504162 0.82 DHODH (0.45) ALDH1A1DHODHPOLB
SCHEMBL592053 0.79 KDM4E (0.43) KMT2AALDH1A1MEN1L3MBTL1DHODH
SCHEMBL15289958 0.79 DHODH (0.42) DHODH
SCHEMBL28278736 0.79 CYP3A4 (0.37) KMT2ACASP3SENP8SENP7SENP6
SCHEMBL29918540 0.77 DHODH (0.41) DHODH
SCHEMBL591320 0.77 TRPA1 (0.41) ALDH1A1DHODHNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2093223-B1 PROCESS AND INTERMEDIATES FOR PRODUCTION OF AN ANTHRANILAMIDE COMPOUND ISHIHARA SANGYO KAISHA (JP) 2013-08-21 EP disclosed
US-8115006-B2 Process for producing anthranilamide compound ISHIHARA SANGYO KAISHA, LTD. (JP) 2012-02-14 US disclosed
US-20100063293-A1 PROCESS FOR PRODUCING ANTHRANILAMIDE COMPOUND ISHIHARA SANGYO KAISHA ,LTD. (JP) 2010-03-11 US disclosed
EP-2093223-A1 PROCESS FOR PRODUCTION OF ANTHRANILAMIDE COMPOUND ISHIHARA SANGYO KAISHA, LTD. (JP) 2009-08-26 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 (1 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-20100063293-A1 PROCESS FOR PRODUCING ANTHRANILAMIDE COMPOUND NAAA, AAAS, AADAC KMT2A 35/4885TDP1 4705/4885CASP3 2117/4885

“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.